Computable General Equilibrium Models for Sustainability Impact...
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Publications, Softwaremodeling tools User Interface: Other Website: iatools.jrc.ec.europa.eudocsecolecon2006.pdf Computable General Equilibrium Models for Sustainability...
Vielle, M.; Bernard, A.
1995-12-31
Computable General Equilibrium Models have now a quite long history and a long list of fields of implementation: taxation, international trade, finance, economic planning for developing countries...Energy and environment, together with the related aspects of taxation and markets for (pollution rights), soon became an important area of concern for this modeling approach. Not only are there numerous academic publications devoted to these problems, but some major economic organizations have shown interest by building such tools for policy assessment. The first achievement was the GREEN model of O.E.C.D., soon followed by a comprehensive project launched by the Directorate General XH of the European Commission (SOLFEGE project). Both of these tools, aiming at a global approach of environmental problems such as the (greenhouse effect), are worldwide representations based on a set of regional macroeconomic models linked through international trade.
Computable General Equilibrium Model Fiscal Year 2013 Capability Development Report - April 2014
Edwards, Brian Keith; Rivera, Michael K.; Boero, Riccardo
2014-04-01
This report documents progress made on continued developments of the National Infrastructure Simulation and Analysis Center (NISAC) Computable General Equilibrium Model (NCGEM), developed in fiscal year 2012. In fiscal year 2013, NISAC the treatment of the labor market and tests performed with the model to examine the properties of the solutions computed by the model. To examine these, developers conducted a series of 20 simulations for 20 U.S. States. Each of these simulations compared an economic baseline simulation with an alternative simulation that assumed a 20-percent reduction in overall factor productivity in the manufacturing industries of each State. Differences in the simulation results between the baseline and alternative simulations capture the economic impact of the reduction in factor productivity. While not every State is affected in precisely the same way, the reduction in manufacturing industry productivity negatively affects the manufacturing industries in each State to an extent proportional to the reduction in overall factor productivity. Moreover, overall economic activity decreases when manufacturing sector productivity is reduced. Developers ran two additional simulations: (1) a version of the model for the State of Michigan, with manufacturing divided into two sub-industries (automobile and other vehicle manufacturing as one sub-industry and the rest of manufacturing as the other subindustry); and (2) a version of the model for the United States, divided into 30 industries. NISAC conducted these simulations to illustrate the flexibility of industry definitions in NCGEM and to examine the simulation properties of in more detail.
Modular Applied General Equilibrium Tool (MAGNET) | Open Energy...
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Related Tools CRiSTAL Forests MCA4Climate - Guidance for scientifically sound climate change planning Environmental Impact and Sustainability Applied General Equilibrium Model...
General equilibrium incidence of energy taxation
Solow, J.L.
1984-04-01
The pervasiveness of energy in the economy and the numerous ways in which energy taxation can distort resource allocations implies the necessity of a general equilibrium approach to the question of energy tax incidence. The author presents a general equilibrium model that accounts for domestic energy production and energy imports, direct energy consumption and use of energy as an intermediate good, and production of energy intensive and nonenergy intensive goods. He examines the incidence of three broadly-based energy taxation policies: a tax on all energy consumption, a subsidy to domestic energy production, and a tariff on energy imports. The subsidy, although not a revenue raising measure, is included because, like the other policies, it acts to reduce energy imports. Such a measure may be of interest by reducing reliance on unstable foreign sources of supply. 12 references, 3 tables.
Zhang, Fan; Yeh, Gour-Tsyh; Parker, Jack C; Brooks, Scott C; Pace, Molly; Kim, Young Jin; Jardine, Philip M; Watson, David B
2007-01-01
This paper presents a reaction-based water quality transport model in subsurface flow systems. Transport of chemical species with a variety of chemical and physical processes is mathematically described by M partial differential equations (PDEs). Decomposition via Gauss-Jordan column reduction of the reaction network transforms M species reactive transport equations into two sets of equations: a set of thermodynamic equilibrium equations representing NE equilibrium reactions and a set of reactive transport equations of M-NE kinetic-variables involving no equilibrium reactions (a kinetic-variable is a linear combination of species). The elimination of equilibrium reactions from reactive transport equations allows robust and efficient numerical integration. The model solves the PDEs of kinetic-variables rather than individual chemical species, which reduces the number of reactive transport equations and simplifies the reaction terms in the equations. A variety of numerical methods are investigated for solving the coupled transport and reaction equations. Simulation comparisons with exact solutions were performed to verify numerical accuracy and assess the effectiveness of various numerical strategies to deal with different application circumstances. Two validation examples involving simulations of uranium transport in soil columns are presented to evaluate the ability of the model to simulate reactive transport with complex reaction networks involving both kinetic and equilibrium reactions.
General-equilibrium incidence of energy taxation
Solow, J.L.
1983-01-01
Taxes on energy consumption, energy-import tariffs, and subsidization of domestic energy production have recently been offered as policies intended to reduce dependency on uncertain sources of foreign energy supply. This dissertation addresses the distributional consequences of such broadly-based energy-taxation policies. Particular attention is focused on the incidence of such policies on payments to factors, and on relative prices of consumption goods. These aspects of energy policy incidence are first considered separately. An expression for the impact of an energy tax on the rental/wage ratio is derived from a two-sector general equilibrium model with intermediate goods. The incidence is a function of factor intensities and substitution possibilities, and of demand elasticities, where both factor intensities and substitution possibilities are measured so as to include both direct inputs and indirect inputs via intermediate goods. Reasonable parameter values imply that the tax is borne disproportionately by capital, and is thus progressive. The effect of an energy tax on output depends on variations in total energy intensities, where total includes both direct input and indirect input via intermediate goods. Intensities for a 36-sector breakdown of goods are calculated. Even with little disaggregation, relative price effects will be of the same order of magnitude as factor price impacts.
Fraser, D.W.H.; Abdelmessih, A.H.
1995-09-01
A general unified model is developed to predict one-component critical two-phase pipe flow. Modelling of the two-phase flow is accomplished by describing the evolution of the flow between the location of flashing inception and the exit (critical) plane. The model approximates the nonequilibrium phase change process via thermodynamic equilibrium paths. Included are the relative effects of varying the location of flashing inception, pipe geometry, fluid properties and length to diameter ratio. The model predicts that a range of critical mass fluxes exist and is bound by a maximum and minimum value for a given thermodynamic state. This range is more pronounced at lower subcooled stagnation states and can be attributed to the variation in the location of flashing inception. The model is based on the results of an experimental study of the critical two-phase flow of saturated and subcooled water through long tubes. In that study, the location of flashing inception was accurately controlled and adjusted through the use of a new device. The data obtained revealed that for fixed stagnation conditions, the maximum critical mass flux occurred with flashing inception located near the pipe exit; while minimum critical mass fluxes occurred with the flashing front located further upstream. Available data since 1970 for both short and long tubes over a wide range of conditions are compared with the model predictions. This includes test section L/D ratios from 25 to 300 and covers a temperature and pressure range of 110 to 280{degrees}C and 0.16 to 6.9 MPa. respectively. The predicted maximum and minimum critical mass fluxes show an excellent agreement with the range observed in the experimental data.
Measurements and non-local thermodynamic equilibrium modeling...
Office of Scientific and Technical Information (OSTI)
thermodynamic equilibrium modeling of mid-Z plasma emission Citation Details In-Document Search Title: Measurements and non-local thermodynamic equilibrium modeling of mid-Z ...
Multicomponent Equilibrium Models for Testing Geothermometry Approaches
Cooper, D. Craig; Palmer, Carl D.; Smith, Robert W.; McLing, Travis L.
2013-02-01
Geothermometry is an important tool for estimating deep reservoir temperature from the geochemical composition of shallower and cooler waters. The underlying assumption of geothermometry is that the waters collected from shallow wells and seeps maintain a chemical signature that reflects equilibrium in the deeper reservoir. Many of the geothermometers used in practice are based on correlation between water temperatures and composition or using thermodynamic calculations based a subset (typically silica, cations or cation ratios) of the dissolved constituents. An alternative approach is to use complete water compositions and equilibrium geochemical modeling to calculate the degree of disequilibrium (saturation index) for large number of potential reservoir minerals as a function of temperature. We have constructed several “forward” geochemical models using The Geochemist’s Workbench to simulate the change in chemical composition of reservoir fluids as they migrate toward the surface. These models explicitly account for the formation (mass and composition) of a steam phase and equilibrium partitioning of volatile components (e.g., CO2, H2S, and H2) into the steam as a result of pressure decreases associated with upward fluid migration from depth. We use the synthetic data generated from these simulations to determine the advantages and limitations of various geothermometry and optimization approaches for estimating the likely conditions (e.g., temperature, pCO2) to which the water was exposed in the deep subsurface. We demonstrate the magnitude of errors that can result from boiling, loss of volatiles, and analytical error from sampling and instrumental analysis. The estimated reservoir temperatures for these scenarios are also compared to conventional geothermometers. These results can help improve estimation of geothermal resource temperature during exploration and early development.
General Equilibrium Model for Economy - Energy - Environment...
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and non-energy related emissions of carbon dioxide (CO2), other GHG such as methane (CH4), nitrous oxide (N20) sulfur hexafluoride (SF6), hydrofluorocarbon (HFC), and...
General Equilibrium Modeling Package (GEMPACK) | Open Energy...
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This tool is included in the Development Impacts Assessment (DIA) Toolkit from the LEDS Global Partnership. Approach The GEMPACK is used for building and solving applied...
Modeling International Relationships in Applied General Equilibrium...
Open Energy Information (Open El) [EERE & EIA]
Related Tools Manual for Quantitative Evaluation of the Co-Benefits Approach to Climate Change Long-Range Energy Alternatives Planning System (LEAP) Object-Oriented Energy,...
Heavy ion collisions and the pre-equilibrium exciton model
Betak, E.
2012-10-20
We present a feasible way to apply the pre-equilibrium exciton model in its masterequation formulation to heavy-ion induced reactions including spin variables. Emission of nucleons, {gamma}'s and also light clusters is included in our model.
Malolepsza, Edyta; Secor, Maxim; Keyes, Tom
2015-09-23
A prescription for sampling isobaric generalized ensembles with molecular dynamics is presented and applied to the generalized replica exchange method (gREM), which was designed for simulating first-order phase transitions. The properties of the isobaric gREM ensemble are discussed and a study is presented of the liquid-vapor equilibrium of the guest molecules given for gas hydrate formation with the mW water model. As a result, phase diagrams, critical parameters, and a law of corresponding states are obtained.
Equilibrium and volumetric data and model development of coal fluids
Robinson, R.L. Jr.; Gasem, K.A.M.; Park, J.
1992-04-28
The long term goal of our efforts is to develop accurate predictive methods for description of equilibrium phase properties for a variety of types of mixtures and operating conditions. The specific objectives of the work specified herein include: (1) development of an experimental facility having the capability to provide data on equilibrium phase compositions (solubilities) and liquid densities, and doing so with greater accuracy and speed than our previous facility, (2) measurement of equilibrium phase properties for systematically-selected mixtures-specifically those containing important solute gases (such as hydrogen, carbon monoxide, methane, ethane, carbonyl sulfide, ammonia) in a series of heavy paraffinic, naphthenic and aromatic solvents (e.g., n-decane, n-eicosane, n-octacosane, n-hexatriacontane, cyclohexane, Decalin, perhydrophenanthrene, perhydropyrene, benzene, naphthalene, phenanthrene, pyrene), (3) testing/development of correlation frameworks for representing the phase behavior of fluids of the type encountered in coal conversion processes, and (4) generalization of parameters in the correlation frameworks to enable accurate predictions for systems of the type studied, permitting predictions to be made for systems and conditions other than those for which experimental data are available.
Non-equilibrium STLS approach to transport properties of single impurity Anderson model
Rezai, Raheleh Ebrahimi, Farshad
2014-04-15
In this work, using the non-equilibrium Keldysh formalism, we study the effects of the electron–electron interaction and the electron-spin correlation on the non-equilibrium Kondo effect and the transport properties of the symmetric single impurity Anderson model (SIAM) at zero temperature by generalizing the self-consistent method of Singwi, Tosi, Land, and Sjolander (STLS) for a single-band tight-binding model with Hubbard type interaction to out of equilibrium steady-states. We at first determine in a self-consistent manner the non-equilibrium spin correlation function, the effective Hubbard interaction, and the double-occupancy at the impurity site. Then, using the non-equilibrium STLS spin polarization function in the non-equilibrium formalism of the iterative perturbation theory (IPT) of Yosida and Yamada, and Horvatic and Zlatic, we compute the spectral density, the current–voltage characteristics and the differential conductance as functions of the applied bias and the strength of on-site Hubbard interaction. We compare our spectral densities at zero bias with the results of numerical renormalization group (NRG) and depict the effects of the electron–electron interaction and electron-spin correlation at the impurity site on the aforementioned properties by comparing our numerical result with the order U{sup 2} IPT. Finally, we show that the obtained numerical results on the differential conductance have a quadratic universal scaling behavior and the resulting Kondo temperature shows an exponential behavior. -- Highlights: •We introduce for the first time the non-equilibrium method of STLS for Hubbard type models. •We determine the transport properties of SIAM using the non-equilibrium STLS method. •We compare our results with order-U2 IPT and NRG. •We show that non-equilibrium STLS, contrary to the GW and self-consistent RPA, produces the two Hubbard peaks in DOS. •We show that the method keeps the universal scaling behavior and correct
Coupling of an average-atom model with a collisional-radiative equilibrium model
Faussurier, G. Blancard, C.; Cossé, P.
2014-11-15
We present a method to combine a collisional-radiative equilibrium model and an average-atom model to calculate bound and free electron wavefunctions in hot dense plasmas by taking into account screening. This approach allows us to calculate electrical resistivity and thermal conductivity as well as pressure in non local thermodynamic equilibrium plasmas. Illustrations of the method are presented for dilute titanium plasma.
VHTR Prismatic Super Lattice Model for Equilibrium Fuel Cycle Analysis
G. S. Chang
2006-09-01
The advanced Very High Temperature gas-cooled Reactor (VHTR), which is currently being developed, achieves simplification of safety through reliance on innovative features and passive systems. One of the VHTRs innovative features is the reliance on ceramic-coated fuel particles to retain the fission products under extreme accident conditions. The effect of the random fuel kernel distribution in the fuel prismatic block is addressed through the use of the Dancoff correction factor in the resonance treatment. However, if the fuel kernels are not perfect black absorbers, the Dancoff correction factor is a function of burnup and fuel kernel packing factor, which requires that the Dancoff correction factor be updated during Equilibrium Fuel Cycle (EqFC) analysis. An advanced Kernel-by-Kernel (K-b-K) hexagonal super lattice model can be used to address and update the burnup dependent Dancoff effect during the EqFC analysis. The developed Prismatic Super Homogeneous Lattice Model (PSHLM) is verified by comparing the calculated burnup characteristics of the double-heterogeneous Prismatic Super Kernel-by-Kernel Lattice Model (PSK-b-KLM). This paper summarizes and compares the PSHLM and PSK-b-KLM burnup analysis study and results. This paper also discusses the coupling of a Monte-Carlo code with fuel depletion and buildup code, which provides the fuel burnup analysis tool used to produce the results of the VHTR EqFC burnup analysis.
ENV-Linkages General Equilibrium Model | Open Energy Information
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Topics: Co-benefits assessment Resource Type: Softwaremodeling tools Website: www.oecd.orgofficialdocumentsdisplaydocumentpdf?coteECOWKP(2008)6 References: OECD1...
General Equilibrium Emissions Model (GEEM) | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
Development (IISD) Sector: Climate, Energy Focus Area: Renewable Energy, Non-renewable Energy, Agriculture, Buildings, Economic Development, Energy Efficiency, Forestry, Goods...
Non-equilibrium scaling analysis of the Kondo model with voltage bias
Fritsch, Peter Kehrein, Stefan
2009-05-15
The quintessential description of Kondo physics in equilibrium is obtained within a scaling picture that shows the buildup of Kondo screening at low temperature. For the non-equilibrium Kondo model with a voltage bias, the key new feature are decoherence effects due to the current across the impurity. In the present paper, we show how one can develop a consistent framework for studying the non-equilibrium Kondo model within a scaling picture of infinitesimal unitary transformations (flow equations). Decoherence effects appear naturally in third order of the {beta}-function and dominate the Hamiltonian flow for sufficiently large voltage bias. We work out the spin dynamics in non-equilibrium and compare it with finite temperature equilibrium results. In particular, we report on the behavior of the static spin susceptibility including leading logarithmic corrections and compare it with the celebrated equilibrium result as a function of temperature.
Plasmoid solutions of the HahmKulsrudTaylor equilibrium model
Dewar, R. L. [Plasma Research Laboratory, Research School of Physics and Engineering, The Australian National University, Canberra ACT 0200, Australia and Graduate School of Frontier Sciences, University of Tokyo, Kashiwa, Chiba 277-8561 (Japan)] [Plasma Research Laboratory, Research School of Physics and Engineering, The Australian National University, Canberra ACT 0200, Australia and Graduate School of Frontier Sciences, University of Tokyo, Kashiwa, Chiba 277-8561 (Japan); Bhattacharjee, A.; Kulsrud, R. M. [Princeton Plasma Physics Laboratory, P.O. Box 451, Princeton, New Jersey 08543 (United States)] [Princeton Plasma Physics Laboratory, P.O. Box 451, Princeton, New Jersey 08543 (United States); Wright, A. M. [The Australian National University, Canberra ACT 0200 (Australia)] [The Australian National University, Canberra ACT 0200 (Australia)
2013-08-15
The HahmKulsrud (HK) [T. S. Hahm and R. M. Kulsrud, Phys. Fluids 28, 2412 (1985)] solutions for a magnetically sheared plasma slab driven by a resonant periodic boundary perturbation illustrate fully shielded (current sheet) and fully reconnected (magnetic island) responses. On the global scale, reconnection involves solving a magnetohydrodynamic (MHD) equilibrium problem. In systems with a continuous symmetry, such MHD equilibria are typically found by solving the GradShafranov equation, and in slab geometry the elliptic operator in this equation is the 2-D Laplacian. Thus, assuming appropriate pressure and poloidal current profiles, a conformal mapping method can be used to transform one solution into another with different boundary conditions, giving a continuous sequence of solutions in the form of partially reconnected magnetic islands (plasmoids) separated by Syrovatsky current sheets. The two HK solutions appear as special cases.
Modeling Mathematical Programs with Equilibrium Constraints in Pyomo
Hart, William E.; Siirola, John Daniel
2015-07-01
We describe new capabilities for modeling MPEC problems within the Pyomo modeling software. These capabilities include new modeling components that represent complementar- ity conditions, modeling transformations for re-expressing models with complementarity con- ditions in other forms, and meta-solvers that apply transformations and numeric optimization solvers to optimize MPEC problems. We illustrate the breadth of Pyomo's modeling capabil- ities for MPEC problems, and we describe how Pyomo's meta-solvers can perform local and global optimization of MPEC problems.
Generalized gas-solid adsorption modeling: Single-component equilibria
Ladshaw, Austin; Yiacoumi, Sotira; Tsouris, Costas; DePaoli, David W.
2015-01-07
Over the last several decades, modeling of gas–solid adsorption at equilibrium has generally been accomplished through the use of isotherms such as the Freundlich, Langmuir, Tóth, and other similar models. While these models are relatively easy to adapt for describing experimental data, their simplicity limits their generality to be used with many different sets of data. This limitation forces engineers and scientists to test each different model in order to evaluate which one can best describe their data. Additionally, the parameters of these models all have a different physical interpretation, which may have an effect on how they can bemore » further extended into kinetic, thermodynamic, and/or mass transfer models for engineering applications. Therefore, it is paramount to adopt not only a more general isotherm model, but also a concise methodology to reliably optimize for and obtain the parameters of that model. A model of particular interest is the Generalized Statistical Thermodynamic Adsorption (GSTA) isotherm. The GSTA isotherm has enormous flexibility, which could potentially be used to describe a variety of different adsorption systems, but utilizing this model can be fairly difficult due to that flexibility. To circumvent this complication, a comprehensive methodology and computer code has been developed that can perform a full equilibrium analysis of adsorption data for any gas-solid system using the GSTA model. The code has been developed in C/C++ and utilizes a Levenberg–Marquardt’s algorithm to handle the non-linear optimization of the model parameters. Since the GSTA model has an adjustable number of parameters, the code iteratively goes through all number of plausible parameters for each data set and then returns the best solution based on a set of scrutiny criteria. Data sets at different temperatures are analyzed serially and then linear correlations with temperature are made for the parameters of the model. The end result is a full set
Generalized Environment for Modeling Systems
2012-02-07
GEMS is an integrated environment that allows technical analysts, modelers, researchers, etc. to integrate and deploy models and/or decision tools with associated data to the internet for direct use by customers. GEMS does not require that the model developer know how to code or script and therefore delivers this capability to a large group of technical specialists. Customers gain the benefit of being able to execute their own scenarios directly without need for technical support. GEMS is a process that leverages commercial software products with specialized codes that add connectivity and unique functions to support the overall capability. Users integrate pre-existing models with a commercial product and store parameters and input trajectories in a companion commercial database. The model is then exposed into a commercial web environment and a graphical user interface (GUI) is applied by the model developer. Users execute the model through the web based GUI and GEMS manages supply of proper inputs, execution of models, routing of data to models and display of results back to users. GEMS works in layers, the following description is from the bottom up. Modelers create models in the modeling tool of their choice such as Excel, Matlab, or Fortran. They can also use models from a library of previously wrapped legacy codes (models). Modelers integrate the models (or a single model) by wrapping and connecting the models using the Phoenix Integration tool entitled ModelCenter. Using a ModelCenter/SAS plugin (DOE copyright CW-10-08) the modeler gets data from either an SAS or SQL database and sends results back to SAS or SQL. Once the model is working properly, the ModelCenter file is saved and stored in a folder location to which a SharePoint server tool created at INL is pointed. This enables the ModelCenter model to be run from SharePoint. The modeler then goes into Microsoft SharePoint and creates a graphical user interface (GUI) using the ModelCenter WebPart (CW-12
Generalized Environment for Modeling Systems
Energy Science and Technology Software Center (OSTI)
2012-02-07
GEMS is an integrated environment that allows technical analysts, modelers, researchers, etc. to integrate and deploy models and/or decision tools with associated data to the internet for direct use by customers. GEMS does not require that the model developer know how to code or script and therefore delivers this capability to a large group of technical specialists. Customers gain the benefit of being able to execute their own scenarios directly without need for technical support.more » GEMS is a process that leverages commercial software products with specialized codes that add connectivity and unique functions to support the overall capability. Users integrate pre-existing models with a commercial product and store parameters and input trajectories in a companion commercial database. The model is then exposed into a commercial web environment and a graphical user interface (GUI) is applied by the model developer. Users execute the model through the web based GUI and GEMS manages supply of proper inputs, execution of models, routing of data to models and display of results back to users. GEMS works in layers, the following description is from the bottom up. Modelers create models in the modeling tool of their choice such as Excel, Matlab, or Fortran. They can also use models from a library of previously wrapped legacy codes (models). Modelers integrate the models (or a single model) by wrapping and connecting the models using the Phoenix Integration tool entitled ModelCenter. Using a ModelCenter/SAS plugin (DOE copyright CW-10-08) the modeler gets data from either an SAS or SQL database and sends results back to SAS or SQL. Once the model is working properly, the ModelCenter file is saved and stored in a folder location to which a SharePoint server tool created at INL is pointed. This enables the ModelCenter model to be run from SharePoint. The modeler then goes into Microsoft SharePoint and creates a graphical user interface (GUI) using the ModelCenter Web
Comparison of transition densities in the DDHMS model of pre-equilibrium emission
Brito, L.; Carlson, B. V.
2014-11-11
The DDHMS (double differential hybrid Monte Carlo simulation) model treats nucleon-induced pre-equilibrium reactions as a series of particle-particle and particle-hole interactions in the space of energy and angle. This work compares spectra obtained within the model using diferent approximations to the density of accessible states. The calculations are performed with the EMPIRE reaction model code, a modular system containing several nuclear reaction models that permits a fairly complete descritpion of the reaction, from elastic scattering and absorption through the pre-equilbrium stage to the final decay by statistical emission.
LLNL Ocean General Circulation Model
Energy Science and Technology Software Center (OSTI)
2005-12-29
The LLNL OGCM is a numerical ocean modeling tool for use in studying ocean circulation over a wide range of space and time scales, with primary applications to climate change and carbon cycle science.
DOE Data Explorer [Office of Scientific and Technical Information (OSTI)]
Users of the VEMAP Portal can access input files of numerical data that include monthly and daily files of geographic data, soil and site files, scenario files, etc. Model results from Phase I, the Equilibrium Response datasets, are available through the NCAR anonymous FTP site at http://www.cgd.ucar.edu/vemap/vresults.html. Phase II, Transient Dynamics, include climate datasets, models results, and analysis tools. Many supplemental files are also available from the main data page at http://www.cgd.ucar.edu/vemap/datasets.html.
Kowalsky, Michael B.; Moridis, George J.
2006-11-29
In this study we compare the use of kinetic and equilibriumreaction models in the simulation of gas (methane) hydrate behavior inporous media. Our objective is to evaluate through numerical simulationthe importance of employing kinetic versus equilibrium reaction modelsfor predicting the response of hydrate-bearing systems to externalstimuli, such as changes in pressure and temperature. Specifically, we(1) analyze and compare the responses simulated using both reactionmodels for natural gas production from hydrates in various settings andfor the case of depressurization in a hydrate-bearing core duringextraction; and (2) examine the sensitivity to factors such as initialhydrate saturation, hydrate reaction surface area, and numericaldiscretization. We find that for large-scale systems undergoing thermalstimulation and depressurization, the calculated responses for bothreaction models are remarkably similar, though some differences areobserved at early times. However, for modeling short-term processes, suchas the rapid recovery of a hydrate-bearing core, kinetic limitations canbe important, and neglecting them may lead to significantunder-prediction of recoverable hydrate. The use of the equilibriumreaction model often appears to be justified and preferred for simulatingthe behavior of gas hydrates, given that the computational demands forthe kinetic reaction model far exceed those for the equilibrium reactionmodel.
Laser induced plasma on copper target, a non-equilibrium model
Oumeziane, Amina Ait Liani, Bachir; Parisse, Jean-Denis
2014-02-15
The aim of this work is to present a comprehensive numerical model for the UV laser ablation of metal targets, it focuses mainly on the prediction of laser induced plasma thresholds, the effect of the laser-plasma interaction, and the importance of the electronic non-equilibrium in the laser induced plume and its expansion in the background gas. This paper describes a set of numerical models for laser-matter interaction between 193-248 and 355 nm lasers and a copper target. Along with the thermal effects inside the material resulting from the irradiation of the latter with the pulsed laser, the laser-evaporated matter interaction and the plasma formation are thoroughly modelled. In the laser induced plume, the electronic nonequilibrium and the laser beam absorption have been investigated. Our calculations of the plasmas ignition thresholds on copper targets have been validated and compared to experimental as well as theoretical results. Comparison with experiment data indicates that our results are in good agreement with those reported in the literature. Furthermore, the inclusion of electronic non-equilibrium in our work indicated that this important process must be included in models of laser ablation and plasma plume formation.
Systematic validation of non-equilibrium thermochemical models using Bayesian inference
Miki, Kenji; Panesi, Marco; Prudhomme, Serge
2015-10-01
The validation process proposed by Babuška et al. [1] is applied to thermochemical models describing post-shock flow conditions. In this validation approach, experimental data is involved only in the calibration of the models, and the decision process is based on quantities of interest (QoIs) predicted on scenarios that are not necessarily amenable experimentally. Moreover, uncertainties present in the experimental data, as well as those resulting from an incomplete physical model description, are propagated to the QoIs. We investigate four commonly used thermochemical models: a one-temperature model (which assumes thermal equilibrium among all inner modes), and two-temperature models developed by Macheret et al. [2], Marrone and Treanor [3], and Park [4]. Up to 16 uncertain parameters are estimated using Bayesian updating based on the latest absolute volumetric radiance data collected at the Electric Arc Shock Tube (EAST) installed inside the NASA Ames Research Center. Following the solution of the inverse problems, the forward problems are solved in order to predict the radiative heat flux, QoI, and examine the validity of these models. Our results show that all four models are invalid, but for different reasons: the one-temperature model simply fails to reproduce the data while the two-temperature models exhibit unacceptably large uncertainties in the QoI predictions.
Compactlike kinks and vortices in generalized models
Bazeia, D.; Hora, E. da; Menezes, R.; Oliveira, H. P. de; Santos, C. dos
2010-06-15
This work deals with the presence of topological defects in k-field models, where the dynamics is generalized to include higher order power in the kinetic term. We investigate kinks in (1, 1) dimensions and vortices in (2, 1) dimensions, focusing on some specific features of the solutions. In particular, we show how the kinks and vortices change to compactlike solutions, controlled by the parameter used to introduce the generalized models.
Entropy analysis on non-equilibrium two-phase flow models
Karwat, H.; Ruan, Y.Q.
1995-09-01
A method of entropy analysis according to the second law of thermodynamics is proposed for the assessment of a class of practical non-equilibrium two-phase flow models. Entropy conditions are derived directly from a local instantaneous formulation for an arbitrary control volume of a structural two-phase fluid, which are finally expressed in terms of the averaged thermodynamic independent variables and their time derivatives as well as the boundary conditions for the volume. On the basis of a widely used thermal-hydraulic system code it is demonstrated with practical examples that entropy production rates in control volumes can be numerically quantified by using the data from the output data files. Entropy analysis using the proposed method is useful in identifying some potential problems in two-phase flow models and predictions as well as in studying the effects of some free parameters in closure relationships.
Simple implementation of general dark energy models
Bloomfield, Jolyon K.; Pearson, Jonathan A. E-mail: jonathan.pearson@durham.ac.uk
2014-03-01
We present a formalism for the numerical implementation of general theories of dark energy, combining the computational simplicity of the equation of state for perturbations approach with the generality of the effective field theory approach. An effective fluid description is employed, based on a general action describing single-scalar field models. The formalism is developed from first principles, and constructed keeping the goal of a simple implementation into CAMB in mind. Benefits of this approach include its straightforward implementation, the generality of the underlying theory, the fact that the evolved variables are physical quantities, and that model-independent phenomenological descriptions may be straightforwardly investigated. We hope this formulation will provide a powerful tool for the comparison of theoretical models of dark energy with observational data.
GW approach to Anderson model in and out of equilibrium : scaling properties in the Kondo regime.
Spataru, Dan Catalin
2010-03-01
The low-energy properties of the Anderson model for a single impurity coupled to two leads are studied using the GW approximation. We find that quantities such as the spectral function at zero temperature, the linear-response conductance as function of temperature or the differential conductance as function of bias voltage exhibit universal scaling behavior in the Kondo regime. We show how the form of the GW scaling functions relates to the form of the scaling functions obtained from the exact solution at equilibrium. We also compare the energy scale that goes inside the GW scaling functions with the exact Kondo temperature, for a broad range of the Coulomb interaction strength in the asymptotic regime. This analysis allows to clarify a presently suspended question in the literature, namely whether or not the GW solution captures the Kondo resonance.
DOE Data Explorer [Office of Scientific and Technical Information (OSTI)]
The Vegetation-Ecosystem Modeling and Analysis Project (VEMAP) was a large, collaborative, multi-agency program to simulate and understand ecosystem dynamics for the continental U.S. The project involved the development of common data sets for model input including a high-resolution topographically-adjusted climate history of the U.S. from 1895-1993 on a 0.5? grid, with soils and vegetation cover. The vegetation cover data set includes a detailed agricultural data base based on USDA statistics and remote sensing, as well as natural vegetation (also derived from satellite imagery). Two principal model experiments were run. First, a series of ecosystem models were run from 1895 to 1993 to simulate current ecosystem biogeochemistry. Second, these same models were integrated forward using the output from two climate system models (CCC (Canadian Climate Centre) and Hadley Centre models) using climate results translated into the VEMAP grid and re-adjusted for high-resolution topography for the simulated period 1994-2100.[Quoted from http://www.cgd.ucar.edu/vemap/findings.html] The VEMAP Data Portal is a central collection of files maintained and serviced by the NCAR Data Group. These files (the VEMAP Community Datasets) represent a complete and current collection of VEMAP data files. All data files available through the Data Portal have undergone extensive quality assurance.[Taken from http://www.cgd.ucar.edu/vemap/datasets.html] Users of the VEMAP Portal can access input files of numerical data that include monthly and daily files of geographic data, soil and site files, scenario files, etc. Model results from Phase I, the Equilibrium Response datasets, are available through the NCAR anonymous FTP site at http://www.cgd.ucar.edu/vemap/vresults.html. Phase II, Transient Dynamics, include climate datasets, models results, and analysis tools. Many supplemental files are also available from the main data page at http://www.cgd.ucar.edu/vemap/datasets.html.
Zhang, Le; Luo, Feng; Xu, Ruina; Jiang, Peixue; Liu, Huihai
2014-12-31
The heat transfer and fluid transport of supercritical CO2 in enhanced geothermal system (EGS) is studied numerically with local thermal non-equilibrium model, which accounts for the temperature difference between solid matrix and fluid components in porous media and uses two energy equations to describe heat transfer in the solid matrix and in the fluid, respectively. As compared with the previous results of our research group, the effect of local thermal non-equilibrium mainly depends on the volumetric heat transfer coefficient ah, which has a significant effect on the production temperature at reservoir outlet and thermal breakthrough time. The uniformity of volumetricmore » heat transfer coefficient ah has little influence on the thermal breakthrough time, but the temperature difference become more obvious with time after thermal breakthrough with this simulation model. The thermal breakthrough time reduces and the effect of local thermal non-equilibrium becomes significant with decreasing ah.« less
MODELING THE NEAR-ULTRAVIOLET BAND OF GK STARS. I. LOCAL THERMODYNAMIC EQUILIBRIUM MODELS
Short, C. Ian; Hauschildt, P. H. E-mail: yeti@hs.uni-hamburg.d
2010-08-01
We present a grid of LTE atmospheric models and synthetic spectra that covers the spectral class range from mid-G to mid-K, and luminosity classes from V to III, that is dense in T{sub eff} sampling ({Delta}T {sub eff} = 62.5 K), for stars of solar metallicity and moderately metal-poor scaled solar abundance ([A/H]=0.0 and -0.5). All models have been computed with two choices of atomic line list: (1) the 'big' line lists of Kurucz that best reproduce the broadband solar blue and near-UV f{sub {lambda}} level, and (2) the 'small' lists of Kurucz and Peytremann that provide the best fit to the high-resolution solar blue and near-UV spectrum. We compare our model spectral energy distributions to a sample of stars carefully selected from the large catalog of uniformly re-calibrated spectrophotometry of Burnashev with the goal of determining how the quality of fit varies with stellar parameters, especially in the historically troublesome blue and near-UV bands. We confirm that our models computed with the 'big' line list recover the derived T {sub eff} values of the PHOENIX NextGen grid, but find that the models computed with the 'small' line list provide greater internal self-consistency among different spectral bands, and closer agreement with the empirical T{sub eff} scale of Ramirez and Melendez, but not to the interferometrically derived T{sub eff} values of Baines et al. We find no evidence that the near-UV band discrepancy between models and observations for Arcturus ({alpha} Boo) reported in two works by Short and Hauschildt is pervasive, and that Arcturus may be peculiar in this regard.
Mac Low, Mordecai-Mark; Glover, Simon C. O. E-mail: glover@uni-heidelberg.de
2012-02-20
Observations of spiral galaxies show a strong linear correlation between the ratio of molecular to atomic hydrogen surface density R{sub mol} and midplane pressure. To explain this, we simulate three-dimensional, magnetized turbulence, including simplified treatments of non-equilibrium chemistry and the propagation of dissociating radiation, to follow the formation of H{sub 2} from cold atomic gas. The formation timescale for H{sub 2} is sufficiently long that equilibrium is not reached within the 20-30 Myr lifetimes of molecular clouds. The equilibrium balance between radiative dissociation and H{sub 2} formation on dust grains fails to predict the time-dependent molecular fractions we find. A simple, time-dependent model of H{sub 2} formation can reproduce the gross behavior, although turbulent density perturbations increase molecular fractions by a factor of few above it. In contradiction to equilibrium models, radiative dissociation of molecules plays little role in our model for diffuse radiation fields with strengths less than 10 times that of the solar neighborhood, because of the effective self-shielding of H{sub 2}. The observed correlation of R{sub mol} with pressure corresponds to a correlation with local gas density if the effective temperature in the cold neutral medium of galactic disks is roughly constant. We indeed find such a correlation of R{sub mol} with density. If we examine the value of R{sub mol} in our local models after a free-fall time at their average density, as expected for models of molecular cloud formation by large-scale gravitational instability, our models reproduce the observed correlation over more than an order-of-magnitude range in density.
New model for nucleon generalized parton distributions
Radyushkin, Anatoly V.
2014-01-01
We describe a new type of models for nucleon generalized parton distributions (GPDs) H and E. They are heavily based on the fact nucleon GPDs require to use two forms of double distribution (DD) representations. The outcome of the new treatment is that the usual DD+D-term construction should be amended by an extra term, {xi} E{sub +}{sup 1} (x,{xi}) which has the DD structure {alpha}/{beta} e({beta},{alpha}, with e({beta},{alpha}) being the DD that generates GPD E(x,{xi}). We found that this function, unlike the D-term, has support in the whole -1 <= x <= 1 region. Furthermore, it does not vanish at the border points |x|={xi}.
Robinson, R.L. Jr.; Gasem, K.A.M.; Park, J.
1992-04-28
The long term goal of our efforts is to develop accurate predictive methods for description of equilibrium phase properties for a variety of types of mixtures and operating conditions. The specific objectives of the work specified herein include: (1) development of an experimental facility having the capability to provide data on equilibrium phase compositions (solubilities) and liquid densities, and doing so with greater accuracy and speed than our previous facility, (2) measurement of equilibrium phase properties for systematically-selected mixtures-specifically those containing important solute gases (such as hydrogen, carbon monoxide, methane, ethane, carbonyl sulfide, ammonia) in a series of heavy paraffinic, naphthenic and aromatic solvents (e.g., n-decane, n-eicosane, n-octacosane, n-hexatriacontane, cyclohexane, Decalin, perhydrophenanthrene, perhydropyrene, benzene, naphthalene, phenanthrene, pyrene), (3) testing/development of correlation frameworks for representing the phase behavior of fluids of the type encountered in coal conversion processes, and (4) generalization of parameters in the correlation frameworks to enable accurate predictions for systems of the type studied, permitting predictions to be made for systems and conditions other than those for which experimental data are available.
General single phase wellbore flow model
Ouyang, Liang-Biao; Arbabi, S.; Aziz, K.
1997-02-05
A general wellbore flow model, which incorporates not only frictional, accelerational and gravitational pressure drops, but also the pressure drop caused by inflow, is presented in this report. The new wellbore model is readily applicable to any wellbore perforation patterns and well completions, and can be easily incorporated in reservoir simulators or analytical reservoir inflow models. Three dimensionless numbers, the accelerational to frictional pressure gradient ratio R{sub af}, the gravitational to frictional pressure gradient ratio R{sub gf}, and the inflow-directional to accelerational pressure gradient ratio R{sub da}, have been introduced to quantitatively describe the relative importance of different pressure gradient components. For fluid flow in a production well, it is expected that there may exist up to three different regions of the wellbore: the laminar flow region, the partially-developed turbulent flow region, and the fully-developed turbulent flow region. The laminar flow region is located near the well toe, the partially-turbulent flow region lies in the middle of the wellbore, while the fully-developed turbulent flow region is at the downstream end or the heel of the wellbore. Length of each region depends on fluid properties, wellbore geometry and flow rate. As the distance from the well toe increases, flow rate in the wellbore increases and the ratios R{sub af} and R{sub da} decrease. Consequently accelerational and inflow-directional pressure drops have the greatest impact in the toe region of the wellbore. Near the well heel the local wellbore flow rate becomes large and close to the total well production rate, here R{sub af} and R{sub da} are small, therefore, both the accelerational and inflow-directional pressure drops can be neglected.
Application of Improved Radiation Modeling to General Circulation Models
Michael J Iacono
2011-04-07
This research has accomplished its primary objectives of developing accurate and efficient radiation codes, validating them with measurements and higher resolution models, and providing these advancements to the global modeling community to enhance the treatment of cloud and radiative processes in weather and climate prediction models. A critical component of this research has been the development of the longwave and shortwave broadband radiative transfer code for general circulation model (GCM) applications, RRTMG, which is based on the single-column reference code, RRTM, also developed at AER. RRTMG is a rigorously tested radiation model that retains a considerable level of accuracy relative to higher resolution models and measurements despite the performance enhancements that have made it possible to apply this radiation code successfully to global dynamical models. This model includes the radiative effects of all significant atmospheric gases, and it treats the absorption and scattering from liquid and ice clouds and aerosols. RRTMG also includes a statistical technique for representing small-scale cloud variability, such as cloud fraction and the vertical overlap of clouds, which has been shown to improve cloud radiative forcing in global models. This development approach has provided a direct link from observations to the enhanced radiative transfer provided by RRTMG for application to GCMs. Recent comparison of existing climate model radiation codes with high resolution models has documented the improved radiative forcing capability provided by RRTMG, especially at the surface, relative to other GCM radiation models. Due to its high accuracy, its connection to observations, and its computational efficiency, RRTMG has been implemented operationally in many national and international dynamical models to provide validated radiative transfer for improving weather forecasts and enhancing the prediction of global climate change.
Lund, Steven M.; Friedman, Alex; Bazouin, Guillaume
2011-01-10
A one-dimensional Vlasov-Poisson model for sheet beams is reviewed and extended to provide a simple framework for analysis of space-charge effects. Centroid and rms envelope equations including image charge effects are derived and reasonable parameter equivalences with commonly employed 2D transverse models of unbunched beams are established. This sheet beam model is then applied to analyze several problems of fundamental interest. A sheet beam thermal equilibrium distribution in a continuous focusing channel is constructed and shown to have analogous properties to two- d three-dimensional thermal equilibrium models in terms of the equilibrium structure and Deybe screening properties. The simpler formulation for sheet beams is exploited to explicitly calculate the distribution of particle oscillation frequencies within a thermal equilibrium beam. It is shown that as space-charge intensity increases, the frequency distribution becomes broad, suggesting that beams with strong space-charge can have improved stability.
Pusateri, Elise N.; Morris, Heidi E.; Nelson, Eric M.; Ji, Wei
2015-08-04
Electromagnetic pulse (EMP) events produce low-energy conduction electrons from Compton electron or photoelectron ionizations with air. It is important to understand how conduction electrons interact with air in order to accurately predict EMP evolution and propagation. An electron swarm model can be used to monitor the time evolution of conduction electrons in an environment characterized by electric field and pressure. Here a swarm model is developed that is based on the coupled ordinary differential equations (ODEs) described by Higgins et al. (1973), hereinafter HLO. The ODEs characterize the swarm electric field, electron temperature, electron number density, and drift velocity. Importantmore » swarm parameters, the momentum transfer collision frequency, energy transfer collision frequency, and ionization rate, are calculated and compared to the previously reported fitted functions given in HLO. These swarm parameters are found using BOLSIG+, a two term Boltzmann solver developed by Hagelaar and Pitchford (2005), which utilizes updated cross sections from the LXcat website created by Pancheshnyi et al. (2012). We validate the swarm model by comparing to experimental effective ionization coefficient data in Dutton (1975) and drift velocity data in Ruiz-Vargas et al. (2010). In addition, we report on electron equilibrium temperatures and times for a uniform electric field of 1 StatV/cm for atmospheric heights from 0 to 40 km. We show that the equilibrium temperature and time are sensitive to the modifications in the collision frequencies and ionization rate based on the updated electron interaction cross sections.« less
Pusateri, Elise N.; Morris, Heidi E.; Nelson, Eric M.; Ji, Wei
2015-08-04
Electromagnetic pulse (EMP) events produce low-energy conduction electrons from Compton electron or photoelectron ionizations with air. It is important to understand how conduction electrons interact with air in order to accurately predict EMP evolution and propagation. An electron swarm model can be used to monitor the time evolution of conduction electrons in an environment characterized by electric field and pressure. Here a swarm model is developed that is based on the coupled ordinary differential equations (ODEs) described by Higgins et al. (1973), hereinafter HLO. The ODEs characterize the swarm electric field, electron temperature, electron number density, and drift velocity. Important swarm parameters, the momentum transfer collision frequency, energy transfer collision frequency, and ionization rate, are calculated and compared to the previously reported fitted functions given in HLO. These swarm parameters are found using BOLSIG+, a two term Boltzmann solver developed by Hagelaar and Pitchford (2005), which utilizes updated cross sections from the LXcat website created by Pancheshnyi et al. (2012). We validate the swarm model by comparing to experimental effective ionization coefficient data in Dutton (1975) and drift velocity data in Ruiz-Vargas et al. (2010). In addition, we report on electron equilibrium temperatures and times for a uniform electric field of 1 StatV/cm for atmospheric heights from 0 to 40 km. We show that the equilibrium temperature and time are sensitive to the modifications in the collision frequencies and ionization rate based on the updated electron interaction cross sections.
Pusateri, Elise N.; Morris, Heidi E.; Nelson, Eric M.; Ji, Wei
2015-08-04
Electromagnetic pulse (EMP) events produce low-energy conduction electrons from Compton electron or photoelectron ionizations with air. It is important to understand how conduction electrons interact with air in order to accurately predict EMP evolution and propagation. An electron swarm model can be used to monitor the time evolution of conduction electrons in an environment characterized by electric field and pressure. Here a swarm model is developed that is based on the coupled ordinary differential equations (ODEs) described by Higgins et al. (1973), hereinafter HLO. The ODEs characterize the swarm electric field, electron temperature, electron number density, and drift velocity. Importantmore »swarm parameters, the momentum transfer collision frequency, energy transfer collision frequency, and ionization rate, are calculated and compared to the previously reported fitted functions given in HLO. These swarm parameters are found using BOLSIG+, a two term Boltzmann solver developed by Hagelaar and Pitchford (2005), which utilizes updated cross sections from the LXcat website created by Pancheshnyi et al. (2012). We validate the swarm model by comparing to experimental effective ionization coefficient data in Dutton (1975) and drift velocity data in Ruiz-Vargas et al. (2010). In addition, we report on electron equilibrium temperatures and times for a uniform electric field of 1 StatV/cm for atmospheric heights from 0 to 40 km. We show that the equilibrium temperature and time are sensitive to the modifications in the collision frequencies and ionization rate based on the updated electron interaction cross sections.« less
Change of variables as a method to study general ?-models: Bulk universality
Shcherbina, M.
2014-04-15
We consider ? matrix models with real analytic potentials. Assuming that the corresponding equilibrium density ? has a one-interval support (without loss of generality ? = [?2, 2]), we study the transformation of the correlation functions after the change of variables ?{sub i} ? ?(?{sub i}) with ?(?) chosen from the equation ?{sup ?}(?)?(?(?)) = ?{sub sc}(?), where ?{sub sc}(?) is the standard semicircle density. This gives us the deformed ?-model which has an additional interaction term. Standard transformation with the Gaussian integral allows us to show that the deformed ?-model may be reduced to the standard Gaussian ?-model with a small perturbation n{sup ?1}h(?). This reduces most of the problems of local and global regimes for ?-models to the corresponding problems for the Gaussian ?-model with a small perturbation. In the present paper, we prove the bulk universality of local eigenvalue statistics for both one-cut and multi-cut cases.
Lindskog, M. Wacker, A.; Wolf, J. M.; Liverini, V.; Faist, J.; Trinite, V.; Maisons, G.; Carras, M.; Aidam, R.; Ostendorf, R.
2014-09-08
We study the operation of an 8.5 μm quantum cascade laser based on GaInAs/AlInAs lattice matched to InP using three different simulation models based on density matrix (DM) and non-equilibrium Green's function (NEGF) formulations. The latter advanced scheme serves as a validation for the simpler DM schemes and, at the same time, provides additional insight, such as the temperatures of the sub-band carrier distributions. We find that for the particular quantum cascade laser studied here, the behavior is well described by simple quantum mechanical estimates based on Fermi's golden rule. As a consequence, the DM model, which includes second order currents, agrees well with the NEGF results. Both these simulations are in accordance with previously reported data and a second regrown device.
Open Geospace General Circulation Model simulation of a substorm...
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Open Geospace General Circulation Model simulation of a substorm: Axial tail instability ... Country of Publication: United States Language: English Word Cloud More Like This Full ...
A general simulation model for Stirling cycles
Schulz, S.; Schwendig, F.
1996-01-01
A mathematical model for the calculation of the Stirling cycle and of similar processes is presented. The model comprises a method to reproduce schematically any kind of process configuration, including free piston engines. The differential balance equations describing the process are solved by a stable integration algorithm. Heat transfer and pressure loss are calculated by using new correlations, which consider the special conditions of the periodic compression/expansion respectively of the oscillating flow. A comparison between experimental data achieved by means of a test apparatus and calculated data shows a good agreement.
Wang, Chi -Jen; Liu, Da -Jiang; Evans, James W.
2015-04-28
Threshold versions of Schloegl’s model on a lattice, which involve autocatalytic creation and spontaneous annihilation of particles, can provide a simple prototype for discontinuous non-equilibrium phase transitions. These models are equivalent to so-called threshold contact processes. A discontinuous transition between populated and vacuum states can occur selecting a threshold of N ≥ 2 for the minimum number, N, of neighboring particles enabling autocatalytic creation at an empty site. Fundamental open questions remain given the lack of a thermodynamic framework for analysis. For a square lattice with N = 2, we show that phase coexistence occurs not at a unique valuemore » but for a finite range of particle annihilation rate (the natural control parameter). This generic two-phase coexistence also persists when perturbing the model to allow spontaneous particle creation. Such behavior contrasts both the Gibbs phase rule for thermodynamic systems and also previous analysis for this model. We find metastability near the transition corresponding to a non-zero effective line tension, also contrasting previously suggested critical behavior. As a result, mean-field type analysis, extended to treat spatially heterogeneous states, further elucidates model behavior.« less
Wang, Chi -Jen; Liu, Da -Jiang; Evans, James W.
2015-04-28
Threshold versions of Schloegl’s model on a lattice, which involve autocatalytic creation and spontaneous annihilation of particles, can provide a simple prototype for discontinuous non-equilibrium phase transitions. These models are equivalent to so-called threshold contact processes. A discontinuous transition between populated and vacuum states can occur selecting a threshold of N ≥ 2 for the minimum number, N, of neighboring particles enabling autocatalytic creation at an empty site. Fundamental open questions remain given the lack of a thermodynamic framework for analysis. For a square lattice with N = 2, we show that phase coexistence occurs not at a unique value but for a finite range of particle annihilation rate (the natural control parameter). This generic two-phase coexistence also persists when perturbing the model to allow spontaneous particle creation. Such behavior contrasts both the Gibbs phase rule for thermodynamic systems and also previous analysis for this model. We find metastability near the transition corresponding to a non-zero effective line tension, also contrasting previously suggested critical behavior. As a result, mean-field type analysis, extended to treat spatially heterogeneous states, further elucidates model behavior.
Nichols, T.T.; Taylor, D.D.
2002-07-18
A status is presented of the development during FY2002 of a database for physical properties models for the simulation of the treatment of Sodium-Bearing Waste (SBW) at the Idaho National Engineering and Environmental Laboratory. An activity coefficient model is needed for concentrated, aqueous, multi-electrolyte solutions that can be used by process design practitioners. Reasonable first-order estimates of activity coefficients in the relevant media are needed rather than an incremental improvement in theoretical approaches which are not usable by practitioners. A comparison of the Electrolyte Non-Random Two-Liquid (ENRTL) and Pitzer ion-interaction models for the thermodynamic representation of SBW is presented. It is concluded that Pitzer's model is superior to ENRTL in modeling treatment processes for SBW. The applicability of the Pitzer treatment to high concentrations of pertinent species and to the determination of solubilities and chemical equilibria is addressed. Alternate values of Pitzer parameters for HCl, H2SO4, and HNO3 are proposed, applicable up to 16m, and 12m, respectively. Partial validation of the implementation of Pitzer's treatment within the commercial process simulator ASPEN Plus was performed.
cDF Theory Software for mesoscopic modeling of equilibrium and transport phenomena
2015-12-01
The approach is based on classical Density Functional Theory ((cDFT) coupled with the Poisson-Nernst-Planck (PNP) transport kinetics model and quantum mechanical description of short-range interaction and elementary transport processes. The model we proposed and implemented is fully atomistic, taking into account pairwise short-range and manybody long-range interactions. But in contrast to standard molecular dynamics (MD) simulations, where long-range manybody interactions are evaluated as a sum of pair-wise atom-atom contributions, we include them analytically based on wellestablished theories of electrostatic and excluded volume interactions in multicomponent systems. This feature of the PNP/cDFT approach allows us to reach well beyond the length-scales accessible to MD simulations, while retaining the essential physics of interatomic interactions from first principles and in a parameter-free fashion.
cDF Theory Software for mesoscopic modeling of equilibrium and transport phenomena
Energy Science and Technology Software Center (OSTI)
2015-12-01
The approach is based on classical Density Functional Theory ((cDFT) coupled with the Poisson-Nernst-Planck (PNP) transport kinetics model and quantum mechanical description of short-range interaction and elementary transport processes. The model we proposed and implemented is fully atomistic, taking into account pairwise short-range and manybody long-range interactions. But in contrast to standard molecular dynamics (MD) simulations, where long-range manybody interactions are evaluated as a sum of pair-wise atom-atom contributions, we include them analytically based onmore » wellestablished theories of electrostatic and excluded volume interactions in multicomponent systems. This feature of the PNP/cDFT approach allows us to reach well beyond the length-scales accessible to MD simulations, while retaining the essential physics of interatomic interactions from first principles and in a parameter-free fashion.« less
Posters Comparison Between General Circulation Model Simulation and Central Equatorial
U.S. Department of Energy (DOE) all webpages (Extended Search)
61 Posters Comparison Between General Circulation Model Simulation and Central Equatorial Pacific Experiment Measurements G. J. Zhang, S. Sherwood, T. P. Barnett, and V. Ramanathan Scripps Institution of Oceanography University of California, San Diego La Jolla, California Introduction A general circulation model (GCM) is a very powerful tool for understanding many climate issues. However, it must be validated using observational data in order for the model results to be credible in climate
Evaluation of cirrus statistics produced by general circulation models
U.S. Department of Energy (DOE) all webpages (Extended Search)
using ARM data cirrus statistics produced by general circulation models using ARM data Hartsock, Daniel University of Utah Mace, Gerald University of Utah Benson, Sally University of Utah Category: Modeling Our goal is to evaluate the skill of various general circulation models for producing climatological cloud statistics by comparing them to the cirrus climatology compiled over the Southern Great Plains (SGP) ARM site. This evaluation includes quantifying similar cloud properties and
Kang, Hyun-Ah; Engle, Nancy L.; Bonnesen Peter V.; Delmau, Laetitia H.; Haverlock, Tamara J.; Moyer, Bruce A.
2004-03-29
In the present work, it has been the aim to examine extraction efficiencies of nine proton-ionizable alcohols (HAs) in 1-octanol and to identify both the controlling equilibria and predominant species involved in the extraction process within a thermochemical model. Distribution ratios for sodium (DNa) extraction were measured as a function of organic-phase HA and aqueous-phase NaOH molarity at 25 C. Extraction efficiency follows the expected order of acidity of the HAs, 4-(tert-octyl) phenol (HA 1a) and 4-noctyl- a,a-bis-(trifluoromethyl)benzyl alcohol (HA 2a) being the most efficient extractants among the compounds tested. By use of the equilibrium-modeling program SXLSQI, a model for the extraction of NaOH has been advanced based on an ion-pair extraction by the diluent to give organic-phase Na+OH- and corresponding free ions and cation exchange by the weak acids to form monomeric organic-phase Na+A- and corresponding free organic-phase ions.
Zhang, Le; Luo, Feng; Xu, Ruina; Jiang, Peixue; Liu, Huihai
2014-12-31
The heat transfer and fluid transport of supercritical CO_{2} in enhanced geothermal system (EGS) is studied numerically with local thermal non-equilibrium model, which accounts for the temperature difference between solid matrix and fluid components in porous media and uses two energy equations to describe heat transfer in the solid matrix and in the fluid, respectively. As compared with the previous results of our research group, the effect of local thermal non-equilibrium mainly depends on the volumetric heat transfer coefficient ah, which has a significant effect on the production temperature at reservoir outlet and thermal breakthrough time. The uniformity of volumetric heat transfer coefficient ah has little influence on the thermal breakthrough time, but the temperature difference become more obvious with time after thermal breakthrough with this simulation model. The thermal breakthrough time reduces and the effect of local thermal non-equilibrium becomes significant with decreasing ah.
Caspers, J.L.
1994-08-12
This research postulates and demonstrates incorporating rate-limited sorption effects in the USGS SUTRA code for cleanup of a hypothetical sandy aquifer by pump-and-treat remediation methods. Contaminant transport is assumed to be affected by advection, dispersion, and rate-limited sorption/desorption. Sorption is assumed to be either equilibrium or rate-limited, with the rate-limitation described by either a first-order law, or by Fickian diffusion of contaminant through a spherical immobile pore region. Solutions are arrived at by split operator methods for the transport and one-dimensional Galerkin solutions for the solute concentration equations. The resulting model is tested against an analytical Laplace transform model for both first-order and Fickian diffusion methods in a radial pumping simulation. Model simulations are used to evaluate equilibrium, first-order and Fickian diffusion effects for pulsed and continuous pumping solutions within a hypothetical sandy aquifer. These show that equilibrium methods under-predicted rebound while first-order methods may both under and over predict rebound within the matrix for certain regions and may be equivalent to Fickian diffusion in equilibrium regimes for cleanup time prediction. Model simulations are then used to show the efficiency of pulsed pumping methods in cleanup mass extraction per pumped volume for a contaminated aquifer pump-and-treat remediation activity versus more conventional, continuous pumping methods.
Bond-Lamberty, Benjamin; Calvin, Katherine V.; Jones, Andrew D.; Mao, Jiafu; Patel, Pralit L.; Shi, Xiaoying; Thomson, Allison M.; Thornton, Peter E.; Zhou, Yuyu
2014-01-01
Human activities are significantly altering biogeochemical cycles at the global scale, posing a significant problem for earth system models (ESMs), which may incorporate static land-use change inputs but do not actively simulate policy or economic forces. One option to address this problem is a to couple an ESM with an economically oriented integrated assessment model. Here we have implemented and tested a coupling mechanism between the carbon cycles of an ESM (CLM) and an integrated assessment (GCAM) model, examining the best proxy variables to share between the models, and quantifying our ability to distinguish climate- and land-use-driven flux changes. CLMs net primary production and heterotrophic respiration outputs were found to be the most robust proxy variables by which to manipulate GCAMs assumptions of long-term ecosystem steady state carbon, with short-term forest production strongly correlated with long-term biomass changes in climate-change model runs. By leveraging the fact that carbon-cycle effects of anthropogenic land-use change are short-term and spatially limited relative to widely distributed climate effects, we were able to distinguish these effects successfully in the model coupling, passing only the latter to GCAM. By allowing climate effects from a full earth system model to dynamically modulate the economic and policy decisions of an integrated assessment model, this work provides a foundation for linking these models in a robust and flexible framework capable of examining two-way interactions between human and earth system processes.
Bachrata, A.; Fichot, F.; Quintard, M.; Repetto, G.; Fleurot, J.
2012-05-15
A generalized non local-equilibrium, three-equation model was developed for the macroscopic description of two-phase flow heat and mass transfer in porous media subjected to phase change. Six pore-scale closure problems were proposed to determine all the effective transport coefficients for representative unit cells. An improved model is presented in this paper with the perspective of application to intense boiling phenomena. The objective of this paper is to present application of this model to the simulation of reflooding of severely damaged nuclear reactor cores. In case of accident at a nuclear power plant, water sources may not be available for a long period of time and the core heats up due to the residual power. Any attempt to inject water during core degradation can lead to quenching and further fragmentation of the core material. The fragmentation of fuel rods and melting of reactor core materials may result in the formation of a {sup d}ebris bed{sup .} The typical particle size in a debris bed might reach few millimeters (characteristic length-scale: 1 to 5 mm), which corresponds to a high permeability porous medium. The proposed two-phase flow model is implemented in the ICARECATHARE code, developed by IRSN to study severe accident scenarios in pressurized water reactors. Currently, the French IRSN has set up two experimental facilities to study debris bed reflooding, PEARL and PRELUDE, with the objective to validate safety models. The PRELUDE program studies the complex two phase flow of water and steam in a porous medium (diameter 180 mm, height 200 mm), initially heated to a high temperature (400 deg. C or 700 deg. C). The series of PRELUDE experiments achieved in 2010 constitute a significant complement to the database of high temperature bottom reflood experimental data. They provide relevant data to understand the progression of the quench front and the intensity of heat transfer. Modeling accurately these experiments required improvements to the
Non-equilibrium STLS approach to transport properties of single...
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Non-equilibrium STLS approach to transport properties of single impurity Anderson model Citation Details In-Document Search Title: Non-equilibrium STLS approach to transport ...
System Advisor Model, SAM 2011.12.2: General Description
U.S. Department of Energy (DOE) all webpages (Extended Search)
System Advisor Model, SAM 2011.12.2: General Description Paul Gilman and Aron Dobos Technical Report NREL/TP-6A20-53437 February 2012 NREL is a national laboratory of the U.S. Department of Energy, Office of Energy Efficiency & Renewable Energy, operated by the Alliance for Sustainable Energy, LLC. National Renewable Energy Laboratory 1617 Cole Boulevard Golden, Colorado 80401 303-275-3000 * www.nrel.gov Contract No. DE-AC36-08GO28308 System Advisor Model, SAM 2011.12.2: General Description
Posters Treatment of Cloud Radiative Effects in General Circulation Models
U.S. Department of Energy (DOE) all webpages (Extended Search)
5 Posters Treatment of Cloud Radiative Effects in General Circulation Models W.-C. Wang, M. P. Dudek, X.-Z. Liang, M. Ding, L. Zhu, E. Joseph, and S. Cox Atmospheric Sciences Research Center State University of New York Albany, New York We participate in the Atmospheric Radiation Measurement (ARM) Program with two objectives: 1) to improve the general circulation model (GCM) cloud/radiation treatment with focus on cloud overlapping and the cloud optical properties and 2) to study the effects of
A general circulation model (GCM) parameterization of Pinatubo aerosols
Lacis, A.A.; Carlson, B.E.; Mishchenko, M.I.
1996-04-01
The June 1991 volcanic eruption of Mt. Pinatubo is the largest and best documented global climate forcing experiment in recorded history. The time development and geographical dispersion of the aerosol has been closely monitored and sampled. Based on preliminary estimates of the Pinatubo aerosol loading, general circulation model predictions of the impact on global climate have been made.
Attractive Hubbard model with disorder and the generalized Anderson theorem
Kuchinskii, E. Z. Kuleeva, N. A. Sadovskii, M. V.
2015-06-15
Using the generalized DMFT+Σ approach, we study the influence of disorder on single-particle properties of the normal phase and the superconducting transition temperature in the attractive Hubbard model. A wide range of attractive potentials U is studied, from the weak coupling region, where both the instability of the normal phase and superconductivity are well described by the BCS model, to the strong-coupling region, where the superconducting transition is due to Bose-Einstein condensation (BEC) of compact Cooper pairs, formed at temperatures much higher than the superconducting transition temperature. We study two typical models of the conduction band with semi-elliptic and flat densities of states, respectively appropriate for three-dimensional and two-dimensional systems. For the semi-elliptic density of states, the disorder influence on all single-particle properties (e.g., density of states) is universal for an arbitrary strength of electronic correlations and disorder and is due to only the general disorder widening of the conduction band. In the case of a flat density of states, universality is absent in the general case, but still the disorder influence is mainly due to band widening, and the universal behavior is restored for large enough disorder. Using the combination of DMFT+Σ and Nozieres-Schmitt-Rink approximations, we study the disorder influence on the superconducting transition temperature T{sub c} for a range of characteristic values of U and disorder, including the BCS-BEC crossover region and the limit of strong-coupling. Disorder can either suppress T{sub c} (in the weak-coupling region) or significantly increase T{sub c} (in the strong-coupling region). However, in all cases, the generalized Anderson theorem is valid and all changes of the superconducting critical temperature are essentially due to only the general disorder widening of the conduction band.
Treatment of cloud radiative effects in general circulation models
Wang, W.C.; Dudek, M.P.; Liang, X.Z.; Ding, M.
1996-04-01
We participate in the Atmospheric Radiation Measurement (ARM) program with two objectives: (1) to improve the general circulation model (GCM) cloud/radiation treatment with a focus on cloud verticle overlapping and layer cloud optical properties, and (2) to study the effects of cloud/radiation-climate interaction on GCM climate simulations. This report summarizes the project progress since the Fourth ARM Science Team meeting February 28-March 4, 1994, in Charleston, South Carolina.
Generalized Optoelectronic Model of Series-Connected Multijunction Solar Cells
Geisz, John F.; Steiner, Myles A.; Garcia, Ivan; France, Ryan M.; McMahon, William E.; Osterwald, Carl R.; Friedman, Daniel J.
2015-10-02
The emission of light from each junction in a series-connected multijunction solar cell, we found, both complicates and elucidates the understanding of its performance under arbitrary conditions. Bringing together many recent advances in this understanding, we present a general 1-D model to describe luminescent coupling that arises from both voltage-driven electroluminescence and voltage-independent photoluminescence in nonideal junctions that include effects such as Sah-Noyce-Shockley (SNS) recombination with n ≠ 2, Auger recombination, shunt resistance, reverse-bias breakdown, series resistance, and significant dark area losses. The individual junction voltages and currents are experimentally determined from measured optical and electrical inputs and outputs of the device within the context of the model to fit parameters that describe the devices performance under arbitrary input conditions. Furthermore, our techniques to experimentally fit the model are demonstrated for a four-junction inverted metamorphic solar cell, and the predictions of the model are compared with concentrator flash measurements.
Generalized Optoelectronic Model of Series-Connected Multijunction Solar Cells
Geisz, John F.; Steiner, Myles A.; Garcia, Ivan; France, Ryan M.; McMahon, William E.; Osterwald, Carl R.; Friedman, Daniel J.
2015-11-01
The emission of light from each junction in a series-connected multijunction solar cell, we found, both complicates and elucidates the understanding of its performance under arbitrary conditions. Bringing together many recent advances in this understanding, we present a general 1-D model to describe luminescent coupling that arises from both voltage-driven electroluminescence and voltage-independent photoluminescence in nonideal junctions that include effects such as Sah-Noyce-Shockley (SNS) recombination with n ≠ 2, Auger recombination, shunt resistance, reverse-bias breakdown, series resistance, and significant dark area losses. The individual junction voltages and currents are experimentally determined from measured optical and electrical inputs and outputs of the device within the context of the model to fit parameters that describe the devices performance under arbitrary input conditions. Furthermore, our techniques to experimentally fit the model are demonstrated for a four-junction inverted metamorphic solar cell, and the predictions of the model are compared with concentrator flash measurements.
Generalized Optoelectronic Model of Series-Connected Multijunction Solar Cells
Geisz, John F.; Steiner, Myles A.; Garcia, Ivan; France, Ryan M.; McMahon, William E.; Osterwald, Carl R.; Friedman, Daniel J.
2015-10-02
The emission of light from each junction in a series-connected multijunction solar cell, we found, both complicates and elucidates the understanding of its performance under arbitrary conditions. Bringing together many recent advances in this understanding, we present a general 1-D model to describe luminescent coupling that arises from both voltage-driven electroluminescence and voltage-independent photoluminescence in nonideal junctions that include effects such as Sah-Noyce-Shockley (SNS) recombination with n ≠ 2, Auger recombination, shunt resistance, reverse-bias breakdown, series resistance, and significant dark area losses. The individual junction voltages and currents are experimentally determined from measured optical and electrical inputs and outputs ofmore » the device within the context of the model to fit parameters that describe the devices performance under arbitrary input conditions. Furthermore, our techniques to experimentally fit the model are demonstrated for a four-junction inverted metamorphic solar cell, and the predictions of the model are compared with concentrator flash measurements.« less
O'Brien, J. E.; Stoots, C. M.; Herring, J. S.; Hartvigsen, J. J.
2007-07-01
An experimental study has been completed to assess the performance of single solid-oxide electrolysis cells operating over a temperature range of 800 to 850ºC in the coelectrolysis mode, simultaneously electrolyzing steam and carbon dioxide for the direct production of syngas. The experiments were performed over a range of inlet flow rates of steam, carbon dioxide, hydrogen and nitrogen and over a range of current densities (-0.1 to 0.25 A/cm2) using single electrolyte-supported button electrolysis cells. Steam and carbon dioxide consumption rates associated with electrolysis were measured directly using inlet and outlet dewpoint instrumentation and a gas chromatograph, respectively. Cell operating potentials and cell current were varied using a programmable power supply. Measured values of open-cell potential and outlet gas composition are compared to predictions obtained from a chemical equilibrium coelectrolysis model. Model predictions of outlet gas composition based on an effective equilibrium temperature are shown to agree well with measurements. Cell area-specific resistance values were similar for steam electrolysis and coelectrolysis.
J. E. O'Brien; C. M. Stoots; G. L. Hawkes; J. S. Herring; J. J. Hartvigsen
2007-06-01
An experimental study has been completed to assess the performance of single solid-oxide electrolysis cells operating over a temperature range of 800 to 850ºC in the coelectrolysis mode, simultaneously electrolyzing steam and carbon dioxide for the direct production of syngas. The experiments were performed over a range of inlet flow rates of steam, carbon dioxide, hydrogen and nitrogen and over a range of current densities (-0.1 to 0.25 A/cm2) using single electrolyte-supported button electrolysis cells. Steam and carbon dioxide consumption rates associated with electrolysis were measured directly using inlet and outlet dewpoint instrumentation and a gas chromatograph, respectively. Cell operating potentials and cell current were varied using a programmable power supply. Measured values of open-cell potential and outlet gas composition are compared to predictions obtained from a chemical equilibrium coelectrolysis model. Model predictions of outlet gas composition based on an effective equilibrium temperature are shown to agree well with measurements. Area-specific resistance values were similar for steam electrolysis and coelectrolysis.
A generalized Fokker-Planck model applied to beam transport
Prinja, A.K.; Pomraning, G.C.
1998-12-31
In this paper the authors consider a generalized Fokker-Planck (GFP) model for the transport of charged-particle beams, when scattering is not sufficiently forward peaked for the well-known Fokker-Planck (FP) approximation to hold. This approximation is strictly valid in the limit that the total scattering cross section {sigma}{sub s} {r_arrow} {infinity} and the mean cosine of scattering {bar {mu}} {r_arrow} 1. When scattering is not sufficiently forward peaked, higher order Fokker-Planck expansions, restricted to differential cross sections that fall off sufficiently rapidly, can be developed. For instance, the Henyey-Greenstein differential cross section does not possess an FP limit at all, while the screened Rutherford cross section satisfies the FP limit only marginally, and its higher order FP limits do not exist. For cross sections that fall off faster than screened Rutherford, including the exponential phase function, higher order truncations exist.
Generalized Modeling of Enrichment Cascades That Include Minor Isotopes
Weber, Charles F
2012-01-01
The monitoring of enrichment operations may require innovative analysis to allow for imperfect or missing data. The presence of minor isotopes may help or hurt - they can complicate a calculation or provide additional data to corroborate a calculation. However, they must be considered in a rigorous analysis, especially in cases involving reuse. This study considers matched-abundanceratio cascades that involve at least three isotopes and allows generalized input that does not require all feed assays or the enrichment factor to be specified. Calculations are based on the equations developed for the MSTAR code but are generalized to allow input of various combinations of assays, flows, and other cascade properties. Traditional cascade models have required specification of the enrichment factor, all feed assays, and the product and waste assays of the primary enriched component. The calculation would then produce the numbers of stages in the enriching and stripping sections and the remaining assays in waste and product streams. In cases where the enrichment factor or feed assays were not known, analysis was difficult or impossible. However, if other quantities are known (e.g., additional assays in waste or product streams), a reliable calculation is still possible with the new code, but such nonstandard input may introduce additional numerical difficulties into the calculation. Thus, the minimum input requirements for a stable solution are discussed, and a sample problem with a non-unique solution is described. Both heuristic and mathematically required guidelines are given to assist the application of cascade modeling to situations involving such non-standard input. As a result, this work provides both a calculational tool and specific guidance for evaluation of enrichment cascades in which traditional input data are either flawed or unknown. It is useful for cases involving minor isotopes, especially if the minor isotope assays are desired (or required) to be
Environmental Impact and Sustainability Applied General Equilibrium...
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to the economics of climate change, including baseline of CO2 and greenhouse gases, impact of climate change on economy, adaptation to climate change, and distributional...
Rucker, G
2007-05-01
Soils at waste sites must be evaluated for the potential of residual soil contamination to leach and migrate to the groundwater beneath the disposal area. If migration to the aquifer occurs, contaminants can travel vast distances and contaminate drinking water wells, thus exposing human receptors to harmful levels of toxins and carcinogens. To prevent groundwater contamination, a contaminant fate and transport analysis is necessary to assess the migration potential of residual soil contaminates. This type of migration analysis is usually performed using a vadose zone model to account for complex geotechnical and chemical variables including: contaminant decay, infiltration rate, soil properties, vadose zone thickness, and chemical behavior. The distinct advantage of using a complex model is that less restrictive, but still protective, soil threshold levels may be determined avoiding the unnecessary and costly remediation of marginally contaminated soils. However, the disadvantage of such modeling is the additional cost for data collection and labor required to apply these models. In order to allay these higher costs and to achieve a less restrictive but still protective clean-up level, a multiple contaminant and multi layered soil column equilibrium partitioning model was developed which is faster, simpler and less expensive to use.
Rucker, Gregory G.
2007-07-01
Soils at waste sites must be evaluated for the potential of residual soil contamination to leach and migrate to the groundwater beneath the disposal area. If migration to the aquifer occurs, contaminants can travel vast distances and pollute drinking water wells, thus exposing human receptors to harmful levels of toxins and carcinogens. To prevent groundwater contamination, a contaminant fate and transport analysis is necessary to assess the migration potential of residual soil contaminants. This type of migration analysis is usually performed using a vadose zone model to account for complex geotechnical and chemical variables including: decay processes, infiltration rate, soil properties, vadose zone thickness, and chemical behavior. The distinct advantage of using a complex model is that less restrictive, but still protective, soil threshold levels may be determined avoiding the unnecessary and costly remediation of marginally contaminated soils. However, the disadvantage of such modeling is the additional cost for data collection and labor required to apply these models. In order to allay these higher costs and to achieve a less restrictive but still protective clean-up level, a multiple contaminant and multi layered soil column equilibrium partitioning model was developed which is faster, simpler and less expensive to use. (authors)
Butlitsky, M. A.; Zelener, B. V.
2014-07-14
A two-component plasma model, which we called a shelf Coulomb model has been developed in this work. A Monte Carlo study has been undertaken to calculate equations of state, pair distribution functions, internal energies, and other thermodynamics properties. A canonical NVT ensemble with periodic boundary conditions was used. The motivation behind the model is also discussed in this work. The shelf Coulomb model can be compared to classical two-component (electron-proton) model where charges with zero size interact via a classical Coulomb law. With important difference for interaction of opposite charges: electrons and protons interact via the Coulomb law for large distances between particles, while interaction potential is cut off on small distances. The cut off distance is defined by an arbitrary ? parameter, which depends on system temperature. All the thermodynamics properties of the model depend on dimensionless parameters ? and ? = ?e{sup 2}n{sup 1/3} (where ? = 1/k{sub B}T, n is the particle's density, k{sub B} is the Boltzmann constant, and T is the temperature) only. In addition, it has been shown that the virial theorem works in this model. All the calculations were carried over a wide range of dimensionless ? and ? parameters in order to find the phase transition region, critical point, spinodal, and binodal lines of a model system. The system is observed to undergo a first order gas-liquid type phase transition with the critical point being in the vicinity of ?{sub crit}?13(T{sub crit}{sup *}?0.076),?{sub crit}?1.8(v{sub crit}{sup *}?0.17),P{sub crit}{sup *}?0.39, where specific volume v* = 1/?{sup 3} and reduced temperature T{sup *} = ?{sup ?1}.
Whetton, P.H.; Pittock, A.B.; Haylock, M.R. ); Rayner, P.J. )
1994-03-01
To assist in estimating likely future climate change in the Australian region, the authors examine the results of four different general circulation modeling experiments run to assess the equilibrium impact of doubling greenhouse gases. The results examined were the most recent available at the time of study from various research centers in North America and Europe, as well as those of the Commonwealth Scientific and Industrial Research Organisation (CSIRO). The approach used is, first, to assess the quality of the control (1 x CO[sub 2]) simulations from each of the models of mean sea level (MSL) pressure and precipitation in the Australian region by comparing these with the corresponding observed patterns; and, second, to then analyze the 2 x CO[sub 2] results of only those model experiments with the best control simulations. Of the models examined two are chosen on the basis of their simulation of current climate in the region: the CSIRO four-level model (CSIRO4) and the United Kingdom Meteorological Office (UKMO) model. For conditions of equivalent doubling of CO[sub 2], both models show substantial increases in surface air temperature of around 4[degrees]-6[degrees] inland and 2[degrees]-4[degrees]C in coastal regions. Both models show decreased MSL pressure over the Australian continent and increases in rainfall over northern, central, and eastern Australia, particularly in the summer half of the year. The CSIRO4 model, but not the UKMO model, also shows increased pressure to the south of the continent and decreased winter rainfall in southwest and southern Australia. Generally, field significance tests show the pattern and magnitude of the changes to be significant of CSIRO4 (for which the necessary monthly simulated data were available). 42 refs., 20 figs., 5 tabs.
Some properties of correlations of quantum lattice systems in thermal equilibrium
Frhlich, Jrg; Ueltschi, Daniel
2015-05-15
Simple proofs of uniqueness of the thermodynamic limit of KMS states and of the decay of equilibrium correlations are presented for a large class of quantum lattice systems at high temperatures. New quantum correlation inequalities for general Heisenberg models are described. Finally, a simplified derivation of a general result on power-law decay of correlations in 2D quantum lattice systems with continuous symmetries is given, extending results of McBryan and Spencer for the 2D classical XY model.
Generalized charge-screening in relativistic ThomasFermi model
Akbari-Moghanjoughi, M.
2014-10-15
In this paper, we study the charge shielding within the relativistic Thomas-Fermi model for a wide range of electron number-densities and the atomic-number of screened ions. A generalized energy-density relation is obtained using the force-balance equation and taking into account the Chandrasekhar's relativistic electron degeneracy pressure. By numerically solving a second-order nonlinear differential equation, the Thomas-Fermi screening length is investigated, and the results are compared for three distinct regimes of the solid-density, warm-dense-matter, and white-dwarfs (WDs). It is revealed that our nonlinear screening theory is compatible with the exponentially decaying Thomas-Fermi-type shielding predicted by the linear response theory. Moreover, the variation of relative Thomas-Fermi screening length shows that extremely dense quantum electron fluids are relatively poor charge shielders. Calculation of the total number of screening electrons around a nucleus shows that there is a position of maximum number of screening localized electrons around the screened nucleus, which moves closer to the point-like nucleus by increase in the plasma number density but is unaffected due to increase in the atomic-number value. It is discovered that the total number of screening electrons, (N{sub s}?r{sub TF}{sup 3}/r{sub d}{sup 3} where r{sub TF} and r{sub d} are the Thomas-Fermi and interparticle distance, respectively) has a distinct limit for extremely dense plasmas such as WD-cores and neutron star crusts, which is unique for all given values of the atomic-number. This is equal to saying that in an ultrarelativistic degeneracy limit of electron-ion plasma, the screening length couples with the system dimensionality and the plasma becomes spherically self-similar. Current analysis can provide useful information on the effects of relativistic correction to the charge screening for a wide range of plasma density, such as the inertial-confined plasmas and compact stellar
Johnson, Raymond H.; Truax, Ryan A.; Lankford, David A.; Stone, James J.
2016-02-03
Solid-phase iron concentrations and generalized composite surface complexation models were used to evaluate procedures in determining uranium sorption on oxidized aquifer material at a proposed U in situ recovery (ISR) site. At the proposed Dewey Burdock ISR site in South Dakota, USA, oxidized aquifer material occurs downgradient of the U ore zones. Solid-phase Fe concentrations did not explain our batch sorption test results,though total extracted Fe appeared to be positively correlated with overall measured U sorption. Batch sorption test results were used to develop generalized composite surface complexation models that incorporated the full genericsorption potential of each sample, without detailedmore » mineralogiccharacterization. The resultant models provide U sorption parameters (site densities and equilibrium constants) for reactive transport modeling. The generalized composite surface complexation sorption models were calibrated to batch sorption data from three oxidized core samples using inverse modeling, and gave larger sorption parameters than just U sorption on the measured solidphase Fe. These larger sorption parameters can significantly influence reactive transport modeling, potentially increasing U attenuation. Because of the limited number of calibration points, inverse modeling required the reduction of estimated parameters by fixing two parameters. The best-fit models used fixed values for equilibrium constants, with the sorption site densities being estimated by the inversion process. While these inverse routines did provide best-fit sorption parameters, local minima and correlated parameters might require further evaluation. Despite our limited number of proxy samples, the procedures presented provide a valuable methodology to consider for sites where metal sorption parameters are required. Furthermore, these sorption parameters can be used in reactive transport modeling to assess downgradient metal attenuation, especially when no other
Model for Energy Supply System Alternatives and their General...
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Resource Type: Softwaremodeling tools Website: www-tc.iaea.orgtcwebabouttcstrategyThematicpdfpresentationsener References: Overview of IAEA PESS Models 1 "MESSAGE...
Robert G. Ellingson
2004-09-28
One specific goal of the Atmospheric Radiation Measurements (ARM) program is to improve the treatment of radiative transfer in General Circulation Models (GCMs) under clear-sky, general overcast and broken cloud conditions. Our project was geared to contribute to this goal by attacking major problems associated with one of the dominant radiation components of the problem --longwave radiation. The primary long-term project objectives were to: (1) develop an optimum longwave radiation model for use in GCMs that has been calibrated with state-of-the-art observations for clear and cloudy conditions, and (2) determine how the longwave radiative forcing with an improved algorithm contributes relatively in a GCM when compared to shortwave radiative forcing, sensible heating, thermal advection and convection. The approach has been to build upon existing models in an iterative, predictive fashion. We focused on comparing calculations from a set of models with operationally observed data for clear, overcast and broken cloud conditions. The differences found through the comparisons and physical insights have been used to develop new models, most of which have been tested with new data. Our initial GCM studies used existing GCMs to study the climate model-radiation sensitivity problem. Although this portion of our initial plans was curtailed midway through the project, we anticipate that the eventual outcome of this approach will provide both a better longwave radiative forcing algorithm and from our better understanding of how longwave radiative forcing influences the model equilibrium climate, how improvements in climate prediction using this algorithm can be achieved.
Towards breaking temperature equilibrium in multi-component Eulerian schemes
Grove, John W; Masser, Thomas
2009-01-01
We investigate the effects ofthermal equilibrium on hydrodynamic flows and describe models for breaking the assumption ofa single temperature for a mixture of components in a cell. A computational study comparing pressure-temperature equilibrium simulations of two dimensional implosions with explicit front tracking is described as well as implementation and J-D calculations for non-equilibrium temperature methods.
Prediction of cloud droplet number in a general circulation model
Ghan, S.J.; Leung, L.R.
1996-04-01
We have applied the Colorado State University Regional Atmospheric Modeling System (RAMS) bulk cloud microphysics parameterization to the treatment of stratiform clouds in the National Center for Atmospheric Research Community Climate Model (CCM2). The RAMS predicts mass concentrations of cloud water, cloud ice, rain and snow, and number concnetration of ice. We have introduced the droplet number conservation equation to predict droplet number and it`s dependence on aerosols.
Stochastic resonance in a generalized Von Foerster population growth model
Lumi, N.; Mankin, R.
2014-11-12
The stochastic dynamics of a population growth model, similar to the Von Foerster model for human population, is studied. The influence of fluctuating environment on the carrying capacity is modeled as a multiplicative dichotomous noise. It is established that an interplay between nonlinearity and environmental fluctuations can cause single unidirectional discontinuous transitions of the mean population size versus the noise amplitude, i.e., an increase of noise amplitude can induce a jump from a state with a moderate number of individuals to that with a very large number, while by decreasing the noise amplitude an opposite transition cannot be effected. An analytical expression of the mean escape time for such transitions is found. Particularly, it is shown that the mean transition time exhibits a strong minimum at intermediate values of noise correlation time, i.e., the phenomenon of stochastic resonance occurs. Applications of the results in ecology are also discussed.
Evaluation of a stratiform cloud parameterization for general circulation models
Ghan, S.J.; Leung, L.R.; McCaa, J.
1996-04-01
To evaluate the relative importance of horizontal advection of cloud versus cloud formation within the grid cell of a single column model (SCM), we have performed a series of simulations with our SCM driven by a fixed vertical velocity and various rates of horizontal advection.
System Advisor Model, SAM 2014.1.14: General Description
Blair, N.; Dobos, A. P.; Freeman, J.; Neises, T.; Wagner, M.; Ferguson, T.; Gilman, P.; Janzou, S.
2014-02-01
This document describes the capabilities of the U.S. Department of Energy and National Renewable Energy Laboratory's System Advisor Model (SAM), Version 2013.9.20, released on September 9, 2013. SAM is a computer model that calculates performance and financial metrics of renewable energy systems. Project developers, policy makers, equipment manufacturers, and researchers use graphs and tables of SAM results in the process of evaluating financial, technology, and incentive options for renewable energy projects. SAM simulates the performance of photovoltaic, concentrating solar power, solar water heating, wind, geothermal, biomass, and conventional power systems. The financial model can represent financial structures for projects that either buy and sell electricity at retail rates (residential and commercial) or sell electricity at a price determined in a power purchase agreement (utility). SAM's advanced simulation options facilitate parametric and sensitivity analyses, and statistical analysis capabilities are available for Monte Carlo simulation and weather variability (P50/P90) studies. SAM can also read input variables from Microsoft Excel worksheets. For software developers, the SAM software development kit (SDK) makes it possible to use SAM simulation modules in their applications written in C/C++, C#, Java, Python, and MATLAB. NREL provides both SAM and the SDK as free downloads at http://sam.nrel.gov. Technical support and more information about the software are available on the website.
System Advisor Model, SAM 2011.12.2: General Description
Gilman, P.; Dobos, A.
2012-02-01
This document describes the capabilities of the U.S. Department of Energy and National Renewable Energy Laboratory's System Advisor Model (SAM), Version 2011.12.2, released on December 2, 2011. SAM is software that models the cost and performance of renewable energy systems. Project developers, policy makers, equipment manufacturers, and researchers use graphs and tables of SAM results in the process of evaluating financial, technology, and incentive options for renewable energy projects. SAM simulates the performance of solar, wind, geothermal, biomass, and conventional power systems. The financial model can represent financing structures for projects that either buy and sell electricity at retail rates (residential and commercial) or sell electricity at a price determined in a power purchase agreement (utility). Advanced analysis options facilitate parametric, sensitivity, and statistical analyses, and allow for interfacing SAM with Microsoft Excel or with other computer programs. SAM is available as a free download at http://sam.nrel.gov. Technical support and more information about the software are available on the website.
Moortgat, Joachim Firoozabadi, Abbas
2013-10-01
Numerical simulation of multiphase compositional flow in fractured porous media, when all the species can transfer between the phases, is a real challenge. Despite the broad applications in hydrocarbon reservoir engineering and hydrology, a compositional numerical simulator for three-phase flow in fractured media has not appeared in the literature, to the best of our knowledge. In this work, we present a three-phase fully compositional simulator for fractured media, based on higher-order finite element methods. To achieve computational efficiency, we invoke the cross-flow equilibrium (CFE) concept between discrete fractures and a small neighborhood in the matrix blocks. We adopt the mixed hybrid finite element (MHFE) method to approximate convective Darcy fluxes and the pressure equation. This approach is the most natural choice for flow in fractured media. The mass balance equations are discretized by the discontinuous Galerkin (DG) method, which is perhaps the most efficient approach to capture physical discontinuities in phase properties at the matrix-fracture interfaces and at phase boundaries. In this work, we account for gravity and Fickian diffusion. The modeling of capillary effects is discussed in a separate paper. We present the mathematical framework, using the implicit-pressure-explicit-composition (IMPEC) scheme, which facilitates rigorous thermodynamic stability analyses and the computation of phase behavior effects to account for transfer of species between the phases. A deceptively simple CFL condition is implemented to improve numerical stability and accuracy. We provide six numerical examples at both small and larger scales and in two and three dimensions, to demonstrate powerful features of the formulation.
Unified Einstein-Virasoro Master Equation in the General Non-Linear Sigma Model
Boer, J. de; Halpern, M.B.
1996-06-05
The Virasoro master equation (VME) describes the general affine-Virasoro construction $T=L^abJ_aJ_b+iD^a \\dif J_a$ in the operator algebra of the WZW model, where $L^ab$ is the inverse inertia tensor and $D^a $ is the improvement vector. In this paper, we generalize this construction to find the general (one-loop) Virasoro construction in the operator algebra of the general non-linear sigma model. The result is a unified Einstein-Virasoro master equation which couples the spacetime spin-two field $L^ab$ to the background fields of the sigma model. For a particular solution $L_G^ab$, the unified system reduces to the canonical stress tensors and conventional Einstein equations of the sigma model, and the system reduces to the general affine-Virasoro construction and the VME when the sigma model is taken to be the WZW action. More generally, the unified system describes a space of conformal field theories which is presumably much larger than the sum of the general affine-Virasoro construction and the sigma model with its canonical stress tensors. We also discuss a number of algebraic and geometrical properties of the system, including its relation to an unsolved problem in the theory of $G$-structures on manifolds with torsion.
Saintonge, Amélie; Lutz, Dieter; Genzel, Reinhard; Tacconi, Linda J.; Berta, Stefano; Förster Schreiber, Natascha M.; Poglitsch, Albrecht; Sturm, Eckhard; Wuyts, Eva; Wuyts, Stijn; Magnelli, Benjamin; Nordon, Raanan; Baker, Andrew J.; Bandara, Kaushala
2013-11-20
We combine IRAM Plateau de Bure Interferometer and Herschel PACS and SPIRE measurements to study the dust and gas contents of high-redshift star-forming galaxies. We present new observations for a sample of 17 lensed galaxies at z = 1.4-3.1, which allow us to directly probe the cold interstellar medium of normal star-forming galaxies with stellar masses of ∼10{sup 10} M{sub ☉}, a regime otherwise not (yet) accessible by individual detections in Herschel and molecular gas studies. The lensed galaxies are combined with reference samples of submillimeter and normal z ∼ 1-2 star-forming galaxies with similar far-infrared photometry to study the gas and dust properties of galaxies in the SFR-M{sub *}-redshift parameter space. The mean gas depletion timescale of main-sequence (MS) galaxies at z > 2 is measured to be only ∼450 Myr, a factor of ∼1.5 (∼5) shorter than at z = 1 (z = 0), in agreement with a (1 + z){sup –1} scaling. The mean gas mass fraction at z = 2.8 is 40% ± 15% (44% after incompleteness correction), suggesting a flattening or even a reversal of the trend of increasing gas fractions with redshift recently observed up to z ∼ 2. The depletion timescale and gas fractions of the z > 2 normal star-forming galaxies can be explained under the 'equilibrium model' for galaxy evolution, in which the gas reservoir of galaxies is the primary driver of the redshift evolution of specific star formation rates. Due to their high star formation efficiencies and low metallicities, the z > 2 lensed galaxies have warm dust despite being located on the star formation MS. At fixed metallicity, they also have a gas-to-dust ratio 1.7 times larger than observed locally when using the same standard techniques, suggesting that applying the local calibration of the δ{sub GDR}-metallicity relation to infer the molecular gas mass of high-redshift galaxies may lead to systematic differences with CO-based estimates.
Fuel-efficient cruise performance model for general aviation piston engine airplanes
Parkinson, R.C.H.
1982-01-01
The uses and limitations of typical Pilot Operating Handbook cruise performance data, for constructing cruise performance models suitable for maximizing specific range, are first examined. These data are found to be inadequate for constructing such models. A new model of General Aviation piston-prop airplane cruise performance is then developed. This model consists of two subsystem models: the airframe-propeller-atmosphere subsystem model; and the engine-atmosphere subsystem model. The new model facilitates maximizing specific range; and by virtue of its simplicity and low volume data storage requirements, appears suitable for airborne microprocessor implementation.
Statistical physics ""Beyond equilibrium
Ecke, Robert E
2009-01-01
The scientific challenges of the 21st century will increasingly involve competing interactions, geometric frustration, spatial and temporal intrinsic inhomogeneity, nanoscale structures, and interactions spanning many scales. We will focus on a broad class of emerging problems that will require new tools in non-equilibrium statistical physics and that will find application in new material functionality, in predicting complex spatial dynamics, and in understanding novel states of matter. Our work will encompass materials under extreme conditions involving elastic/plastic deformation, competing interactions, intrinsic inhomogeneity, frustration in condensed matter systems, scaling phenomena in disordered materials from glasses to granular matter, quantum chemistry applied to nano-scale materials, soft-matter materials, and spatio-temporal properties of both ordinary and complex fluids.
Wang, Hainan; Thiele, Alexander; Pilon, Laurent
2013-11-15
This paper presents a generalized modified Poisson–Nernst–Planck (MPNP) model derived from first principles based on excess chemical potential and Langmuir activity coefficient to simulate electric double-layer dynamics in asymmetric electrolytes. The model accounts simultaneously for (1) asymmetric electrolytes with (2) multiple ion species, (3) finite ion sizes, and (4) Stern and diffuse layers along with Ohmic potential drop in the electrode. It was used to simulate cyclic voltammetry (CV) measurements for binary asymmetric electrolytes. The results demonstrated that the current density increased significantly with decreasing ion diameter and/or increasing valency |z_{i}| of either ion species. By contrast, the ion diffusion coefficients affected the CV curves and capacitance only at large scan rates. Dimensional analysis was also performed, and 11 dimensionless numbers were identified to govern the CV measurements of the electric double layer in binary asymmetric electrolytes between two identical planar electrodes of finite thickness. A self-similar behavior was identified for the electric double-layer integral capacitance estimated from CV measurement simulations. Two regimes were identified by comparing the half cycle period τ_{CV} and the “RC time scale” τ_{RC} corresponding to the characteristic time of ions’ electrodiffusion. For τ_{RC} ← τ_{CV}, quasi-equilibrium conditions prevailed and the capacitance was diffusion-independent while for τ_{RC} → τ_{CV}, the capacitance was diffusion-limited. The effect of the electrode was captured by the dimensionless electrode electrical conductivity representing the ratio of characteristic times associated with charge transport in the electrolyte and that in the electrode. The model developed here will be useful for simulating and designing various practical electrochemical, colloidal, and biological systems for a wide range of applications.
Wu, Wei; Wang, Jin
2014-09-14
We have established a general non-equilibrium thermodynamic formalism consistently applicable to both spatially homogeneous and, more importantly, spatially inhomogeneous systems, governed by the Langevin and Fokker-Planck stochastic dynamics with multiple state transition mechanisms, using the potential-flux landscape framework as a bridge connecting stochastic dynamics with non-equilibrium thermodynamics. A set of non-equilibrium thermodynamic equations, quantifying the relations of the non-equilibrium entropy, entropy flow, entropy production, and other thermodynamic quantities, together with their specific expressions, is constructed from a set of dynamical decomposition equations associated with the potential-flux landscape framework. The flux velocity plays a pivotal role on both the dynamic and thermodynamic levels. On the dynamic level, it represents a dynamic force breaking detailed balance, entailing the dynamical decomposition equations. On the thermodynamic level, it represents a thermodynamic force generating entropy production, manifested in the non-equilibrium thermodynamic equations. The Ornstein-Uhlenbeck process and more specific examples, the spatial stochastic neuronal model, in particular, are studied to test and illustrate the general theory. This theoretical framework is particularly suitable to study the non-equilibrium (thermo)dynamics of spatially inhomogeneous systems abundant in nature. This paper is the second of a series.
Space Charge and Equilibrium Emittances in Damping Rings
Venturini, Marco; Oide, Katsunobu; Wolski, Andy
2006-06-21
We present a model of dynamics to account for the possible impact of space charge on the equilibrium emittances in storage rings and apply the model to study the current design of the International Linear Collider (ILC) damping rings.
A General Nonlinear Fluid Model for Reacting Plasma-Neutral Mixtures
Meier, E T; Shumlak, U
2012-04-06
A generalized, computationally tractable fluid model for capturing the effects of neutral particles in plasmas is derived. The model derivation begins with Boltzmann equations for singly charged ions, electrons, and a single neutral species. Electron-impact ionization, radiative recombination, and resonant charge exchange reactions are included. Moments of the reaction collision terms are detailed. Moments of the Boltzmann equations for electron, ion, and neutral species are combined to yield a two-component plasma-neutral fluid model. Separate density, momentum, and energy equations, each including reaction transfer terms, are produced for the plasma and neutral equations. The required closures for the plasma-neutral model are discussed.
Matching pre-equilibrium dynamics and viscous hydrodynamics
Martinez, Mauricio; Strickland, Michael
2010-02-15
We demonstrate how to match pre-equilibrium dynamics of a 0+1-dimensional quark-gluon plasma to second-order viscous hydrodynamical evolution. The matching allows us to specify the initial values of the energy density and shear tensor at the initial time of hydrodynamical evolution as a function of the lifetime of the pre-equilibrium period. We compare two models for pre-equilibrium quark-gluon plasma, longitudinal free streaming and collisionally broadened longitudinal expansion, and present analytic formulas that can be used to fix the necessary components of the energy-momentum tensor. The resulting dynamical models can be used to assess the effect of pre-equilibrium dynamics on quark-gluon plasma observables. Additionally, we investigate the dependence of entropy production on pre-equilibrium dynamics and discuss the limitations of the standard definitions of nonequilibrium entropy.
Krishna, S.; Shukla, A.; Malik, R.P.
2014-12-15
Using the supersymmetric (SUSY) invariant restrictions on the (anti-)chiral supervariables, we derive the off-shell nilpotent symmetries of the general one (0+1)-dimensional N=2 SUSY quantum mechanical (QM) model which is considered on a (1, 2)-dimensional supermanifold (parametrized by a bosonic variable t and a pair of Grassmannian variables θ and θ-bar with θ{sup 2}=(θ-bar){sup 2}=0,θ(θ-bar)+(θ-bar)θ=0). We provide the geometrical meanings to the two SUSY transformations of our present theory which are valid for any arbitrary type of superpotential. We express the conserved charges and Lagrangian of the theory in terms of the supervariables (that are obtained after the application of SUSY invariant restrictions) and provide the geometrical interpretation for the nilpotency property and SUSY invariance of the Lagrangian for the general N=2 SUSY quantum theory. We also comment on the mathematical interpretation of the above symmetry transformations. - Highlights: • A novel method has been proposed for the derivation of N=2 SUSY transformations. • General N=2 SUSY quantum mechanical (QM) model with a general superpotential, is considered. • The above SUSY QM model is generalized onto a (1, 2)-dimensional supermanifold. • SUSY invariant restrictions are imposed on the (anti-)chiral supervariables. • Geometrical meaning of the nilpotency property is provided.
Burtis, M.D.; Razuvaev, V.N.; Sivachok, S.G.
1996-10-01
This report presents English-translated abstracts of important Russian-language literature concerning general circulation models as they relate to climate change. Into addition to the bibliographic citations and abstracts translated into English, this report presents the original citations and abstracts in Russian. Author and title indexes are included to assist the reader in locating abstracts of particular interest.
Simulation of the Low-Level-Jet by general circulation models
Ghan, S.J.
1996-04-01
To what degree is the low-level jet climatology and it`s impact on clouds and precipitation being captured by current general circulation models? It is hypothesised that a need for a pramaterization exists. This paper describes this parameterization need.
Equilibrium ignition for ICF capsules
Lackner, K.S.; Colgate, S.A.; Johnson, N.L.; Kirkpatrick, R.C.; Menikoff, R.; Petschek, A.G.
1993-12-31
There are two fundamentally different approaches to igniting DT fuel in an ICF capsule which can be described as equilibrium and hot spot ignition. In both cases, a capsule which can be thought of as a pusher containing the DT fuel is imploded until the fuel reaches ignition conditions. In comparing high-gain ICF targets using cryogenic DT for a pusher with equilibrium ignition targets using high-Z pushers which contain the radiation. The authors point to the intrinsic advantages of the latter. Equilibrium or volume ignition sacrifices high gain for lower losses, lower ignition temperature, lower implosion velocity and lower sensitivity of the more robust capsule to small fluctuations and asymmetries in the drive system. The reduction in gain is about a factor of 2.5, which is small enough to make the more robust equilibrium ignition an attractive alternative.
Equilibrium Distribution of Heavy Quarks in Fokker-Planck Dynamics
Walton, D. Brian; Rafelski, Johann
2000-01-03
We obtain an explicit generalization, within Fokker-Planck dynamics, of Einstein's relation between drag, diffusion, and the equilibrium distribution for a spatially homogeneous system, considering both the transverse and longitudinal diffusion for dimension n>1 . We provide a complete characterization of the equilibrium distribution in terms of the drag and diffusion transport coefficients. We apply this analysis to charm quark dynamics in a thermal quark-gluon plasma for the case of collisional equilibration. (c) 1999 The American Physical Society.
Edge equilibrium code for tokamaks
Li, Xujing; Drozdov, Vladimir V.
2014-01-15
The edge equilibrium code (EEC) described in this paper is developed for simulations of the near edge plasma using the finite element method. It solves the Grad-Shafranov equation in toroidal coordinate and uses adaptive grids aligned with magnetic field lines. Hermite finite elements are chosen for the numerical scheme. A fast Newton scheme which is the same as implemented in the equilibrium and stability code (ESC) is applied here to adjust the grids.
General properties of different models used to predict normal tissue complications due to radiation
Kuperman, V. Y.
2008-11-15
In the current study the author analyzes general properties of three different models used to predict normal tissue complications due to radiation: (1) Surviving fraction of normal cells in the framework of the linear quadratic (LQ) equation for cell kill, (2) the Lyman-Kutcher-Burman (LKB) model for normal tissue complication probability (NTCP), and (3) generalized equivalent uniform dose (gEUD). For all considered cases the author assumes fixed average dose to an organ of interest. The author's goal is to establish whether maximizing dose uniformity in the irradiated normal tissues is radiobiologically beneficial. Assuming that NTCP increases with increasing overall cell kill, it is shown that NTCP in the LQ model is maximized for uniform dose. Conversely, NTCP in the LKB and gEUD models is always smaller for a uniform dose to a normal organ than that for a spatially varying dose if parameter n in these models is small (i.e., n<1). The derived conflicting properties of the considered models indicate the need for more studies before these models can be utilized clinically for plan evaluation and/or optimization of dose distributions. It is suggested that partial-volume irradiation can be used to establish the validity of the considered models.
Modeling of Arctic Storms with a Variable High-Resolution General Circulation Model
Taylor, Mark A.; Roesler, Erika Louise; Bosler, Peter Andrew
2015-08-01
The Department of Energy’s (DOE) Biological and Environmental Research project, “Water Cycle and Climate Extremes Modeling” is improving our understanding and modeling of regional details of the Earth’s water cycle. Sandia is using high resolution model behavior to investigate storms in the Arctic.
Integrated hydrogeological model of the general separations area. Volume 2: groundwater flow model
Flach, G.P.; Harris, M.K.
1997-08-01
This report models the Gordon aquifer, the Gordon confining unit, and the `lower` aquifer zone, `tan clay` confining zone, and `upper` aquifer zone of the Water Table aquifer. The report presents structure-contour and isopach maps of each unit.
A kernel-oriented model for coalition-formation in general environments: Implementation and results
Shehory, O.; Kraus, S.
1996-12-31
In this paper we present a model for coalition formation and payoff distribution in general environments. We focus on a reduced complexity kernel-oriented coalition formation model, and provide a detailed algorithm for the activity of the single rational agent. The model is partitioned into a social level and a strategic level, to distinguish between regulations that must be agreed upon and are forced by agent-designers, and strategies by which each agent acts at will. In addition, we present an implementation of the model and simulation results. From these we conclude that implementing the model for coalition formation among agents increases the benefits of the agents with reasonable time consumption. It also shows that more coalition formations yield more benefits to the agents.
EQuilibrium Solutions Inc | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
EQuilibrium Solutions Inc Jump to: navigation, search Name: eQuilibrium Solutions Inc Place: Boston, Massachusetts Zip: 2215 Sector: Carbon, Efficiency Product: Boston-based...
Beyond simple exponential correlation functions and equilibrium...
Office of Scientific and Technical Information (OSTI)
and equilibrium dynamics in x-ray photon correlation spectroscopy Citation Details In-Document Search Title: Beyond simple exponential correlation functions and equilibrium ...
Agarwala, R. [National Institutes of Health, Bethesda, MD (United States); Batzoglou, S. [MIT, Cambridge, MA (United States); Dancik, V. [Univ. of Southern California, Los Angeles, CA (United States)] [and others
1997-06-01
We consider the problem of determining the three-dimensional folding of a protein given its one-dimensional amino acid sequence. We use the HP model for protein folding proposed by Dill, which models protein as a chain of amino acid residues that are either hydrophobic or polar, and hydrophobic interactions are the dominant initial driving force for the protein folding. Hart and Istrail gave approximation algorithms for folding proteins on the cubic lattice under HP model. In this paper, we examine the choice of a lattice by considering its algorithmic and geometric implications and argue that triangular lattice is a more reasonable choice. We present a set of folding rules for a triangular lattice and analyze the approximation ratio which they achieve. In addition, we introduce a generalization of the HP model to account for residues having different levels of hydrophobicity. After describing the biological foundation for this generalization, we show that in the new model we are able to achieve similar constant factor approximation guarantees on the triangular lattice as were achieved in the standard HP model. While the structures derived from our folding rules are probably still far from biological reality, we hope that having a set of folding rules with different properties will yield more interesting folds when combined.
KETUSKY, EDWARD
2005-10-31
This thesis details a graduate research effort written to fulfill the Magister of Technologiae in Chemical Engineering requirements at the University of South Africa. The research evaluates the ability of equilibrium based software to forecast dissolution, evaluate safety impacts, and determine downstream processability changes associated with using oxalic acid solutions to dissolve sludge heels in Savannah River Site High Level Waste (HLW) Tanks 1-15. First, a dissolution model is constructed and validated. Coupled with a model, a material balance determines the fate of hypothetical worst-case sludge in the treatment and neutralization tanks during each chemical adjustment. Although sludge is dissolved, after neutralization more is created within HLW. An energy balance determines overpressurization and overheating to be unlikely. Corrosion induced hydrogen may overwhelm the purge ventilation. Limiting the heel volume treated/acid added and processing the solids through vitrification is preferred and should not significantly increase the number of glass canisters.
Gao Yajun
2008-08-15
A previously established Hauser-Ernst-type extended double-complex linear system is slightly modified and used to develop an inverse scattering method for the stationary axisymmetric general symplectic gravity model. The reduction procedures in this inverse scattering method are found to be fairly simple, which makes the inverse scattering method applied fine and effective. As an application, a concrete family of soliton double solutions for the considered theory is obtained.
Allu, Srikanth; Velamur Asokan, Badri; Shelton, William A; Philip, Bobby; Pannala, Sreekanth
2014-01-01
A generalized three dimensional computational model based on unied formulation of electrode- electrolyte-electrode system of a electric double layer supercapacitor has been developed. The model accounts for charge transport across the solid-liquid system. This formulation based on volume averaging process is a widely used concept for the multiphase ow equations ([28] [36]) and is analogous to porous media theory typically employed for electrochemical systems [22] [39] [12]. This formulation is extended to the electrochemical equations for a supercapacitor in a consistent fashion, which allows for a single-domain approach with no need for explicit interfacial boundary conditions as previously employed ([38]). In this model it is easy to introduce the spatio-temporal variations, anisotropies of physical properties and it is also conducive for introducing any upscaled parameters from lower length{scale simulations and experiments. Due to the irregular geometric congurations including porous electrode, the charge transport and subsequent performance characteristics of the super-capacitor can be easily captured in higher dimensions. A generalized model of this nature also provides insight into the applicability of 1D models ([38]) and where multidimensional eects need to be considered. In addition, simple sensitivity analysis on key input parameters is performed in order to ascertain the dependence of the charge and discharge processes on these parameters. Finally, we demonstarted how this new formulation can be applied to non-planar supercapacitors
Far-from-equilibrium measurements of thermodynamic length
Feng, Edward H.; Crooks, Gavin E.
2008-11-05
Thermodynamic length is a path function that generalizes the notion of length to the surface of thermodynamic states. Here, we show how to measure thermodynamic length in far-from-equilibrium experiments using the work fluctuation relations. For these microscopic systems, it proves necessary to define the thermodynamic length in terms of the Fisher information. Consequently, the thermodynamic length can be directly related to the magnitude of fluctuations about equilibrium. The work fluctuation relations link the work and the free energy change during an external perturbation on a system. We use this result to determine equilibrium averages at intermediate points of the protocol in which the system is out-of-equilibrium. This allows us to extend Bennett's method to determine the potential of mean force, as well as the thermodynamic length, in single molecule experiments.
Ecosystem carbon storage capacity as affected by disturbance regimes: A general theoretical model
Weng, Ensheng; Luo, Yiqi; Wang, Weile; Wang, Han; Hayes, Daniel J; McGuire, A. David; Hastings, Alan; Schimel, David
2012-01-01
Disturbances have been recognized as a key factor shaping terrestrial ecosystem states and dynamics. A general model that quantitatively describes the relationship between carbon storage and disturbance regime is critical for better understanding large scale terrestrial ecosystem carbon dynamics. We developed a model (REGIME) to quantify ecosystem carbon storage capacities (E[x]) under varying disturbance regimes with an analytical solution E[x] = U {center_dot} {tau}{sub E} {center_dot} {lambda}{lambda} + s {tau} 1, where U is ecosystem carbon influx, {tau}{sub E} is ecosystem carbon residence time, and {tau}{sub 1} is the residence time of the carbon pool affected by disturbances (biomass pool in this study). The disturbance regime is characterized by the mean disturbance interval ({lambda}) and the mean disturbance severity (s). It is a Michaelis-Menten-type equation illustrating the saturation of carbon content with mean disturbance interval. This model analytically integrates the deterministic ecosystem carbon processes with stochastic disturbance events to reveal a general pattern of terrestrial carbon dynamics at large scales. The model allows us to get a sense of the sensitivity of ecosystems to future environmental changes just by a few calculations. According to the REGIME model, for example, approximately 1.8 Pg C will be lost in the high-latitude regions of North America (>45{sup o} N) if fire disturbance intensity increases around 5.7 time the current intensity to the end of the twenty-first century, which will require around 12% increases in net primary productivity (NPP) to maintain stable carbon stocks. If the residence time decreased 10% at the same time additional 12.5% increases in NPP are required to keep current C stocks. The REGIME model also lays the foundation for analytically modeling the interactions between deterministic biogeochemical processes and stochastic disturbance events.
Concentrating Solar Power: Efficiently Leveraging Equilibrium Mechanisms
Office of Energy Efficiency and Renewable Energy (EERE) (indexed site)
for Engineering New Thermochemical Storage | Department of Energy Efficiently Leveraging Equilibrium Mechanisms for Engineering New Thermochemical Storage Concentrating Solar Power: Efficiently Leveraging Equilibrium Mechanisms for Engineering New Thermochemical Storage Concentrating Solar Power: Efficiently Leveraging Equilibrium Mechanisms for Engineering New Thermochemical Storage The Concentrating Solar Power: Efficiently Leveraging Equilibrium Mechanisms for Engineering New
McManamay, Ryan A
2014-01-01
Despite the ubiquitous existence of dams within riverscapes, much of our knowledge about dams and their environmental effects remains context-specific. Hydrology, more than any other environmental variable, has been studied in great detail with regard to dam regulation. While much progress has been made in generalizing the hydrologic effects of regulation by large dams, many aspects of hydrology show site-specific fidelity to dam operations, small dams (including diversions), and regional hydrologic regimes. A statistical modeling framework is presented to quantify and generalize hydrologic responses to varying degrees of dam regulation. Specifically, the objectives were to 1) compare the effects of local versus cumulative dam regulation, 2) determine the importance of different regional hydrologic regimes in influencing hydrologic responses to dams, and 3) evaluate how different regulation contexts lead to error in predicting hydrologic responses to dams. Overall, model performance was poor in quantifying the magnitude of hydrologic responses, but performance was sufficient in classifying hydrologic responses as negative or positive. Responses of some hydrologic indices to dam regulation were highly dependent upon hydrologic class membership and the purpose of the dam. The opposing coefficients between local and cumulative-dam predictors suggested that hydrologic responses to cumulative dam regulation are complex, and predicting the hydrology downstream of individual dams, as opposed to multiple dams, may be more easy accomplished using statistical approaches. Results also suggested that particular contexts, including multipurpose dams, high cumulative regulation by multiple dams, diversions, close proximity to dams, and certain hydrologic classes are all sources of increased error when predicting hydrologic responses to dams. Statistical models, such as the ones presented herein, show promise in their ability to model the effects of dam regulation effects at
A Generalized Fokker-Planck Model for Transport of Collimated Beams
Prinja, Anil K.; Pomraning, G.C.
2001-03-15
A generalized Fokker-Planck (GFP) model is introduced for application to the problem of the angular spreading of a broad beam of charged particles. This approach extends the classic Fokker-Planck (FP) approximation of the scattering operator to instances when the differential scattering cross section is not sufficiently forward peaked for the strict FP representation to be valid. Our previously developed (1 - {mu}){sup n}-moments method is used to construct a truncated hierarchy of moment equations from the GFP and transport equations. For slab thicknesses that are small compared to the transport mean-free-path, the scalar flux is explicitly represented as a Taylor expansion in the depth variable for different truncation orders and for different orders of the generalized Fokker-Planck expansion. Numerical results indicate that the GFP method is a viable method for dealing with larger scattering angles than are possible with the classic FP approximation.
Extraction of Equilibrium Energy and Kinetic Parameters from Single
U.S. Department of Energy (DOE) all webpages (Extended Search)
Molecule Force Spectroscopy Data Alex Noy is the Principal Investigator for the Extraction of Equilibrium Energy and Kinetic Parameters from Single Molecule Force Spectroscopy Data. LLNL BES Programs Highlight Extraction of Equilibrium Energy and Kinetic Parameters from Single Molecule Force Spectroscopy Data Dynamic strength data for 10 different biological bonds fitted by the model R.W. Friddle, A. Noy, J.J. De Yoreo, Interpreting the widespread nonlinear force spectra of intermolecular
U.S. Department of Energy (DOE) all webpages (Extended Search)
6Be General Table The General Table for 6Be is subdivided into the following categories: Cluster Model Model Calculations...
Testing the (generalized) Chaplygin gas model with the lookback time-redshift data
Li, Zhengxiang; Wu, Puxun; Yu, Hongwei E-mail: wpx0227@gmail.com
2009-09-01
The Chaplygin gas (CG) and the generalized Chaplygin gas (GCG) models, proposed as candidates of the unified dark matter-dark energy (UDME), are tested with the look-back time (LT) redshift data. We find that the LT data only give a very weak constraint on the model parameter. However, by combing the LT with the baryonic acoustic oscillation peak, we obtain, at the 95.4% confidence level, 0.68 ≤ A{sub c} ≤ 0.82 and 0.59 ≤ h ≤ 0.65 for the CG model , and 0.67 ≤ A{sub s} ≤ 0.89 and −0.29 ≤ α ≤ 0.61 for the GCG model. This shows that both the CG and the GCG are viable as a candidate of UDME. Within the GCG model, we also find that the Chaplygin gas model (α = 1) is ruled out by these data at the 99.7% confidence level.
Chialvo, Ariel A.; Moucka, Filip; Vlcek, Lukas; Nezbeda, Ivo
2015-03-24
Here we implemented the Gaussian charge-on-spring (GCOS) version of the original self-consistent field implementation of the Gaussian Charge Polarizable water model and test its accuracy to represent the polarization behavior of the original model involving smeared charges and induced dipole moments. Moreover, for that purpose we adapted the recently developed multiple-particle-move (MPM) within the Gibbs and isochoric-isothermal ensembles Monte Carlo methods for the efficient simulation of polarizable fluids. We also assessed the accuracy of the GCOS representation by a direct comparison of the resulting vapor-liquid phase envelope, microstructure, and relevant microscopic descriptors of water polarization along the orthobaric curve against the corresponding quantities from the actual GCP water model.
Chialvo, Ariel A.; Moucka, Filip; Vlcek, Lukas; Nezbeda, Ivo
2015-03-24
Here we implemented the Gaussian charge-on-spring (GCOS) version of the original self-consistent field implementation of the Gaussian Charge Polarizable water model and test its accuracy to represent the polarization behavior of the original model involving smeared charges and induced dipole moments. Moreover, for that purpose we adapted the recently developed multiple-particle-move (MPM) within the Gibbs and isochoric-isothermal ensembles Monte Carlo methods for the efficient simulation of polarizable fluids. We also assessed the accuracy of the GCOS representation by a direct comparison of the resulting vapor-liquid phase envelope, microstructure, and relevant microscopic descriptors of water polarization along the orthobaric curve againstmore » the corresponding quantities from the actual GCP water model.« less
Evans, J.L.; Frank, W.M.; Young, G.S.
1996-04-01
Successful simulations of the global circulation and climate require accurate representation of the properties of shallow and deep convective clouds, stable-layer clouds, and the interactions between various cloud types, the boundary layer, and the radiative fluxes. Each of these phenomena play an important role in the global energy balance, and each must be parameterized in a global climate model. These processes are highly interactive. One major problem limiting the accuracy of parameterizations of clouds and other processes in general circulation models (GCMs) is that most of the parameterization packages are not linked with a common physical basis. Further, these schemes have not, in general, been rigorously verified against observations adequate to the task of resolving subgrid-scale effects. To address these problems, we are designing a new Integrated Cumulus Ensemble and Turbulence (ICET) parameterization scheme, installing it in a climate model (CCM2), and evaluating the performance of the new scheme using data from Atmospheric Radiation Measurement (ARM) Program Cloud and Radiation Testbed (CART) sites.
Groundwater flow model for the General Separations Area, Savannah River Site
Not Available
1992-05-15
The Savannah River Site (SRS) is a Department of Energy (DOE) facility located near Aiken, South Carolina. Assessment of groundwater flow rates and directions, potential contaminant transport times, and concentration of potential contaminants is required to determine current and future environmental effects resulting from releases by these facilities. Proposed closure actions and/or remedial alternatives also need to be evaluated. Numerical groundwater flow and solute transport models are a means of assessing the environmental effects on the groundwater system. They provide a logical method of integrating all available data into a consistent framework for quantitative analysis. The results of groundwater models can be used directly for input to management decisions and design/construct issues or can provide input into risk assessment models for site evaluations. GeoTrans, Inc. was contracted by the Environmental Restoration Department of WSRC to develop a groundwater model of the entire General Separations Area (GSA). Of particular interest is the area surrounding the Mixed Waste Management Facility (MWMF) as shown in Figure 1.2. The model developed in this phase of the study will be used to assess groundwater flow issues for the entire GSA. The second phase of the study will address contaminant transport issues specific to the area surrounding the MWMF.
The Madden-Julian oscillation in ECHAM4 coupled and uncoupled general circulation models
Sperber, Kenneth R.; Gualdi, Silvio; Legutke, Stephanie; Gayler, Veronika
2005-06-29
The Madden-Julian oscillation (MJO) dominates tropical variability on timescales of 30–70 days. During the boreal winter/spring, it is manifested as an eastward propagating disturbance, with a strong convective signature over the eastern hemisphere. The space–time structure of the MJO is analyzed using simulations with the ECHAM4 atmospheric general circulation model run with observed monthly mean sea-surface temperatures (SSTs), and coupled to three different ocean models. The coherence of the eastward propagation of MJO convection is sensitive to the ocean model to which ECHAM4 is coupled. For ECHAM4/OPYC and ECHO-G, models for which ~100 years of daily data is available, Montemore » Carlo sampling indicates that their metrics of eastward propagation are different at the 1% significance level. The flux-adjusted coupled simulations, ECHAM4/OPYC and ECHO-G, maintain a more realistic mean-state, and have a more realistic MJO simulation than the nonadjusted scale interaction experiment (SINTEX) coupled runs. The SINTEX model exhibits a cold bias in Indian Ocean and tropical West Pacific Ocean sea-surface temperature of ~0.5°C. This cold bias affects the distribution of time-mean convection over the tropical eastern hemisphere. Furthermore, the eastward propagation of MJO convection in this model is not as coherent as in the two models that used flux adjustment or when compared to an integration of ECHAM4 with prescribed observed SST. This result suggests that simulating a realistic basic state is at least as important as air–sea interaction for organizing the MJO. While all of the coupled models simulate the warm (cold) SST anomalies that precede (succeed) the MJO convection, the interaction of the components of the net surface heat flux that lead to these anomalies are different over the Indian Ocean. The ECHAM4/OPYC model in which the atmospheric model is run at a horizontal resolution of T42, has eastward propagating zonal wind anomalies and latent heat
U.S. Department of Energy (DOE) all webpages (Extended Search)
5 General Tables The General Table for 5H is subdivided into the following categories: Cluster Model Hypernuclei Model Calculations Photodisintegration Pions The General Table for...
A comparison of general circulation model predictions to sand drift and dune orientations
Blumberg, D.G.; Greeley, R.
1996-12-01
The growing concern over climate change and decertification stresses the importance of aeolian process prediction. In this paper the use of a general circulation model to predict current aeolian features is examined. A GCM developed at NASA/Goddard Space Flight Center was used in conjunction with White`s aeolian sand flux model to produce a global potential aeolian transport map. Surface wind shear stress predictions were used from the output of a GCM simulation that was performed as part of the Atmospheric Model Intercomparison Project on 1979 climate conditions. The spatial resolution of this study (as driven by the GCM) is 4{degrees} X 5{degrees}; instantaneous 6-hourly wind stress data were saved by the GCM and used in this report. A global map showing potential sand transport was compared to drift potential directions as inferred from Landsat images from the 1980s for several sand seas and a coastal dune field. Generally, results show a good correlation between the simulated sand drift direction and the drift direction inferred for dune forms. Discrepancies between the drift potential and the drift inferred from images were found in the North American deserts and the Arabian peninsula. An attempt to predict the type of dune that would be formed in specific regions was not successful. The model could probably be further improved by incorporating soil moisture, surface roughness, and vegetation information for a better assessment of sand threshold conditions. The correlation may permit use of a GCM to analyze {open_quotes}fossil{close_quotes} dunes or to forecast aeolian processes. 48 refs., 8 figs.
Wan, Hui; Rasch, Philip J.; Zhang, Kai; Qian, Yun; Yan, Huiping; Zhao, Chun
2014-09-08
This paper explores the feasibility of an experimentation strategy for investigating sensitivities in fast components of atmospheric general circulation models. The basic idea is to replace the traditional serial-in-time long-term climate integrations by representative ensembles of shorter simulations. The key advantage of the proposed method lies in its efficiency: since fewer days of simulation are needed, the computational cost is less, and because individual realizations are independent and can be integrated simultaneously, the new dimension of parallelism can dramatically reduce the turnaround time in benchmark tests, sensitivities studies, and model tuning exercises. The strategy is not appropriate for exploring sensitivity of all model features, but it is very effective in many situations. Two examples are presented using the Community Atmosphere Model version 5. The first example demonstrates that the method is capable of characterizing the model cloud and precipitation sensitivity to time step length. A nudging technique is also applied to an additional set of simulations to help understand the contribution of physics-dynamics interaction to the detected time step sensitivity. In the second example, multiple empirical parameters related to cloud microphysics and aerosol lifecycle are perturbed simultaneously in order to explore which parameters have the largest impact on the simulated global mean top-of-atmosphere radiation balance. Results show that in both examples, short ensembles are able to correctly reproduce the main signals of model sensitivities revealed by traditional long-term climate simulations for fast processes in the climate system. The efficiency of the ensemble method makes it particularly useful for the development of high-resolution, costly and complex climate models.
Energy Science and Technology Software Center (OSTI)
2007-02-02
Version 00 GNASH provides a flexible method by which reaction and level cross sections, isomer ratios, and emission spectra (neutron, gamma-ray, and charged-particle) resulting from particle- and photon-induced reactions can be calculated. The September 1991 release of GNASH incorporated an additional option for calculating gamma-ray strength functions and transmission coefficients by including the Kopecky-Uhl model. In addition, improvements were made to the output routines, particularly regarding gamma-ray strength function information. Major improvements in the 1995more » FKK-GNASH release include added capabilities: to read in externally calculated preequilibrium spectrum from, e.g., Feshbach-Kerman-Koonin theory, to do multiple preequilibrium calculations, to calculate appropriate spin distributions for nuclear states formed in preequilibrium reactions, and to do incident-photon calculations. In the 1998 release improvements were made in the accuracy of the exciton model and other calculations, and provision was made for including energy-dependent renormalization of the reaction cross section and energy-dependent exciton model parameterization (for data evaluation purposes). The sample problems provided here are the same as those that were given in the 1998 release; however, the calculations were run using the current version of GNASH (gn9cp8). The major differences between this version and the previous one released in 1998 are as follows: 1. A serious buffering error that affected stored state populations resulting when multiple reactions lead to the same compound nucleus is corrected. This error only affects cases with INPOPT=-1, normally used for high-energy calculations. It is the reason that the present outputs for the p + Zr90 test case (described below) are significantly different from the 1998 results for the same p + Zr90 test case. 2. Minor errors were corrected in estimating preequilibrium contributions to discrete states; interpolating the spin
Quaas, Johannes; Ming, Yi; Menon, Surabi; Takemura, Toshihiko; Wang, Minghuai; Penner, Joyce E.; Gettelman, Andrew; Lohmann, Ulrike; Bellouin, Nicolas; Boucher, Olivier; Sayer, Andrew M.; Thomas, Gareth E.; McComiskey, Allison; Feingold, Graham; Hoose, Corinna; Kristjansson, Jon Egill; Liu, Xiaohong; Balkanski, Yves; Donner, Leo J.; Ginoux, Paul A.; Stier, Philip; Feichter, Johann; Sednev, Igor; Bauer, Susanne E.; Koch, Dorothy; Grainger, Roy G.; Kirkevag, Alf; Iversen, Trond; Seland, Oyvind; Easter, Richard; Ghan, Steven J.; Rasch, Philip J.; Morrison, Hugh; Lamarque, Jean-Francois; Iacono, Michael J.; Kinne, Stefan; Schulz, Michael
2009-04-10
Aerosol indirect effects continue to constitute one of the most important uncertainties for anthropogenic climate perturbations. Within the international AEROCOM initiative, the representation of aerosol-cloud-radiation interactions in ten different general circulation models (GCMs) is evaluated using three satellite datasets. The focus is on stratiform liquid water clouds since most GCMs do not include ice nucleation effects, and none of the model explicitly parameterizes aerosol effects on convective clouds. We compute statistical relationships between aerosol optical depth (Ta) and various cloud and radiation quantities in a manner that is consistent between the models and the satellite data. It is found that the model-simulated influence of aerosols on cloud droplet number concentration (Nd) compares relatively well to the satellite data at least over the ocean. The relationship between Ta and liquid water path is simulated much too strongly by the models. It is shown that this is partly related to the representation of the second aerosol indirect effect in terms of autoconversion. A positive relationship between total cloud fraction (fcld) and Ta as found in the satellite data is simulated by the majority of the models, albeit less strongly than that in the satellite data in most of them. In a discussion of the hypotheses proposed in the literature to explain the satellite-derived strong fcld - Ta relationship, our results indicate that none can be identified as unique explanation. Relationships similar to the ones found in satellite data between Ta and cloud top temperature or outgoing long-wave radiation (OLR) are simulated by only a few GCMs. The GCMs that simulate a negative OLR - Ta relationship show a strong positive correlation between Ta and fcld The short-wave total aerosol radiative forcing as simulated by the GCMs is strongly influenced by the simulated anthropogenic fraction of Ta, and parameterisation assumptions such as a lower bound on Nd
Chemical Equilibrium Composition of Aqueous Systems
Energy Science and Technology Software Center (OSTI)
1997-01-01
MINEQL is a subroutine package to calculate equilibrium composition of an aqueous system, accounting for mass transfer.
Wakamatsu, M.; Tsujimoto, H. [Department of Physics, Faculty of Science, Osaka University, Toyonaka, Osaka 560-0043 (Japan)
2005-04-01
The theoretical predictions are given for the forward limit of the unpolarized spin-flip isovector generalized parton distribution function (E{sup u}-E{sup d})(x,{xi},t) within the framework of the chiral quark soliton model, with full inclusion of the polarization of Dirac sea quarks. We observe that [(H{sup u}-H{sup d})+(E{sup u}-E{sup d})](x,0,0) has a sharp peak around x=0, which we interpret as a signal of the importance of the pionic qq excitation with large spatial extension in the transverse direction. Another interesting indication given by the predicted distribution in combination with Ji's angular momentum sum rule is that the d quark carries more angular momentum than the u quark in the proton, which may have some relation with the physics of the violation of the Gottfried sum rule.
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General Table The General Table for 10He is subdivided into the following categories: Theoretical Shell Model Cluster Model Other Models Special States Electromagnetic Transitions...
Yock, Adam D. Kudchadker, Rajat J.; Rao, Arvind; Dong, Lei; Beadle, Beth M.; Garden, Adam S.; Court, Laurence E.
2014-05-15
Purpose: The purpose of this work was to develop and evaluate the accuracy of several predictive models of variation in tumor volume throughout the course of radiation therapy. Methods: Nineteen patients with oropharyngeal cancers were imaged daily with CT-on-rails for image-guided alignment per an institutional protocol. The daily volumes of 35 tumors in these 19 patients were determined and used to generate (1) a linear model in which tumor volume changed at a constant rate, (2) a general linear model that utilized the power fit relationship between the daily and initial tumor volumes, and (3) a functional general linear model that identified and exploited the primary modes of variation between time series describing the changing tumor volumes. Primary and nodal tumor volumes were examined separately. The accuracy of these models in predicting daily tumor volumes were compared with those of static and linear reference models using leave-one-out cross-validation. Results: In predicting the daily volume of primary tumors, the general linear model and the functional general linear model were more accurate than the static reference model by 9.9% (range: −11.6%–23.8%) and 14.6% (range: −7.3%–27.5%), respectively, and were more accurate than the linear reference model by 14.2% (range: −6.8%–40.3%) and 13.1% (range: −1.5%–52.5%), respectively. In predicting the daily volume of nodal tumors, only the 14.4% (range: −11.1%–20.5%) improvement in accuracy of the functional general linear model compared to the static reference model was statistically significant. Conclusions: A general linear model and a functional general linear model trained on data from a small population of patients can predict the primary tumor volume throughout the course of radiation therapy with greater accuracy than standard reference models. These more accurate models may increase the prognostic value of information about the tumor garnered from pretreatment computed tomography
Quaas, Johannes; Ming, Yi; Menon, Surabi; Takemura, Toshihiko; Wang, Minghuai; Penner, Joyce E.; Gettelman, Andrew; Lohmann, Ulrike; Bellouin, Nicolas; Boucher, Olivier; Sayer, Andrew M.; Thomas, Gareth E.; McComiskey, Allison; Feingold, Graham; Hoose, Corinna; Kristansson, Jon Egill; Liu, Xiaohong; Balkanski, Yves; Donner, Leo J.; Ginoux, Paul A.; Stier, Philip; Grandey, Benjamin; Feichter, Johann; Sednev, Igor; Bauer, Susanne E.; Koch, Dorothy; Grainger, Roy G.; Kirkevag, Alf; Iversen, Trond; Seland, Oyvind; Easter, Richard; Ghan, Steven J.; Rasch, Philip J.; Morrison, Hugh; Lamarque, Jean-Francois; Iacono, Michael J.; Kinne, Stefan; Schulz, Michael
2010-03-12
Aerosol indirect effects continue to constitute one of the most important uncertainties for anthropogenic climate perturbations. Within the international AEROCOM initiative, the representation of aerosol-cloud-radiation interactions in ten different general circulation models (GCMs) is evaluated using three satellite datasets. The focus is on stratiform liquid water clouds since most GCMs do not include ice nucleation effects, and none of the model explicitly parameterises aerosol effects on convective clouds. We compute statistical relationships between aerosol optical depth ({tau}{sub a}) and various cloud and radiation quantities in a manner that is consistent between the models and the satellite data. It is found that the model-simulated influence of aerosols on cloud droplet number concentration (N{sub d}) compares relatively well to the satellite data at least over the ocean. The relationship between {tau}{sub a} and liquid water path is simulated much too strongly by the models. This suggests that the implementation of the second aerosol indirect effect mainly in terms of an autoconversion parameterisation has to be revisited in the GCMs. A positive relationship between total cloud fraction (f{sub cld}) and {tau}{sub a} as found in the satellite data is simulated by the majority of the models, albeit less strongly than that in the satellite data in most of them. In a discussion of the hypotheses proposed in the literature to explain the satellite-derived strong f{sub cld} - {tau}{sub a} relationship, our results indicate that none can be identified as a unique explanation. Relationships similar to the ones found in satellite data between {tau}{sub a} and cloud top temperature or outgoing long-wave radiation (OLR) are simulated by only a few GCMs. The GCMs that simulate a negative OLR - {tau}{sub a} relationship show a strong positive correlation between {tau}{sub a} and f{sub cld} The short-wave total aerosol radiative forcing as simulated by the GCMs is
Equilibrium calculations of firework mixtures
Hobbs, M.L.; Tanaka, Katsumi; Iida, Mitsuaki; Matsunaga, Takehiro
1994-12-31
Thermochemical equilibrium calculations have been used to calculate detonation conditions for typical firework components including three report charges, two display charges, and black powder which is used as a fuse or launch charge. Calculations were performed with a modified version of the TIGER code which allows calculations with 900 gaseous and 600 condensed product species at high pressure. The detonation calculations presented in this paper are thought to be the first report on the theoretical study of firework detonation. Measured velocities for two report charges are available and compare favorably to predicted detonation velocities. However, the measured velocities may not be true detonation velocities. Fast deflagration rather than an ideal detonation occurs when reactants contain significant amounts of slow reacting constituents such as aluminum or titanium. Despite such uncertainties in reacting pyrotechnics, the detonation calculations do show the complex nature of condensed phase formation at elevated pressures and give an upper bound for measured velocities.
Nap, R. J.; Tagliazucchi, M.; Szleifer, I.
2014-01-14
This work addresses the effect of the Born self-energy contribution in the modeling of the structural and thermodynamical properties of weak polyelectrolytes confined to planar and curved surfaces. The theoretical framework is based on a theory that explicitly includes the conformations, size, shape, and charge distribution of all molecular species and considers the acid-base equilibrium of the weak polyelectrolyte. Namely, the degree of charge in the polymers is not imposed but it is a local varying property that results from the minimization of the total free energy. Inclusion of the dielectric properties of the polyelectrolyte is important as the environment of a polymer layer is very different from that in the adjacent aqueous solution. The main effect of the Born energy contribution on the molecular organization of an end-grafted weak polyacid layer is uncharging the weak acid (or basic) groups and consequently decreasing the concentration of mobile ions within the layer. The magnitude of the effect increases with polymer density and, in the case of the average degree of charge, it is qualitatively equivalent to a small shift in the equilibrium constant for the acid-base equilibrium of the weak polyelectrolyte monomers. The degree of charge is established by the competition between electrostatic interactions, the polymer conformational entropy, the excluded volume interactions, the translational entropy of the counterions and the acid-base chemical equilibrium. Consideration of the Born energy introduces an additional energetic penalty to the presence of charged groups in the polyelectrolyte layer, whose effect is mitigated by down-regulating the amount of charge, i.e., by shifting the local-acid base equilibrium towards its uncharged state. Shifting of the local acid-base equilibrium and its effect on the properties of the polyelectrolyte layer, without considering the Born energy, have been theoretically predicted previously. Account of the Born energy leads
Near-equilibrium measurements of nonequilibrium free energy
Crooks, Gavin
2012-04-09
A central endeavor of thermodynamics is the measurement of free energy changes. Regrettably, although we can measure the free energy of a system in thermodynamic equilibrium, typically all we can say about the free energy of a nonequilibrium ensemble is that it is larger than that of the same system at equilibrium. Herein, we derive a formally exact expression for the probability distribution of a driven system, which involves path ensemble averages of the work over trajectories of the time-reversed system. From this we find a simple near-equilibrium approximation for the free energy in terms of an excess mean time-reversed work, which can be experimentally measured on real systems. With analysis and computer simulation, we demonstrate the accuracy of our approximations for several simple models.
Magnetic diagnostics for equilibrium reconstructions with eddy...
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Magnetic diagnostics for equilibrium reconstructions with eddy currents on the lithium tokamak experimenta) Citation Details In-Document Search Title: Magnetic diagnostics for...
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He General Table The General Table for 9He is subdivided into the following categories: Shell Model Other Model Calculations Theoretical
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H General Table The General Table for 5H is subdivided into the following categories: Cluster Model Hypernuclei Model Calculations Photodisintegration Pions...
Keane, R.E.; Long, D.G.; Menakis, J.P.; Hann, W.J.; Bevins, C.D.
1996-10-01
The paper details the landscape succession model developed for the coarse-scale assessment called CRBSUM (Columbia River Basin SUccession Model) and presents some general results of the application of this model to the entire basin. CRBSUM was used to predict future landscape characteristics to evaluate management alternatives for both mid-and coarse-scale efforts. A test and sensitivity analysis of CRBSUM is also presented. This paper was written as a users guide for those who wish to run the model and interprete results, and its was also written as documentation for some results of the Interior Columbia River Basin simulation effort.
Trampedach, Regner; Asplund, Martin; Collet, Remo; Nordlund, Ake
2013-05-20
Present grids of stellar atmosphere models are the workhorses in interpreting stellar observations and determining their fundamental parameters. These models rely on greatly simplified models of convection, however, lending less predictive power to such models of late-type stars. We present a grid of improved and more reliable stellar atmosphere models of late-type stars, based on deep, three-dimensional (3D), convective, stellar atmosphere simulations. This grid is to be used in general for interpreting observations and improving stellar and asteroseismic modeling. We solve the Navier Stokes equations in 3D and concurrent with the radiative transfer equation, for a range of atmospheric parameters, covering most of stellar evolution with convection at the surface. We emphasize the use of the best available atomic physics for quantitative predictions and comparisons with observations. We present granulation size, convective expansion of the acoustic cavity, and asymptotic adiabat as functions of atmospheric parameters.
Stoliker, Deborah L.; Kent, Douglas B.; Zachara, John M.
2011-09-16
Uranium adsorption-desorption on sediment samples collected from the Hanford 300-Area, Richland, WA varied extensively over a range of field-relevant chemical conditions, complicating assessment of possible differences in equilibrium adsorption properties. Adsorption equilibrium was achieved in 500-1000 hours although dissolved uranium concentrations increased over thousands of hours owing to changes in aqueous chemical composition driven by sediment-water reactions. A non-electrostatic surface complexation reaction, >SOH + UO22+ + 2CO32- = >SOUO2(CO3HCO3)2-, provided the best fit to experimental data for each sediment sample resulting in a range of conditional equilibrium constants (logKc) from 21.49 to 21.76. Potential differences in uranium adsorption properties could be assessed in plots based on the generalized mass-action expressions yielding linear trends displaced vertically by differences in logKc values. Using this approach, logKc values for seven sediment samples were not significantly different. However, a significant difference in adsorption properties between one sediment sample and the fines (<0.063 mm) of another could be demonstrated despite the fines requiring a different reaction stoichiometry. Estimates of logKc uncertainty were improved by capturing all data points within experimental errors. The mass-action expression plots demonstrate that applying models outside the range of conditions used in model calibration greatly increases potential errors.
A general model of resource production and exchange in systems of interdependent specialists.
Conrad, Stephen Hamilton; Finley, Patrick D.; Beyeler, Walter Eugene; Brown, Theresa Jean; Glass, Robert John, Jr.; Breen, Peter; Kuypers, Marshall; Norton, Matthew David; Quach, Tu-Thach; Antognoli, Matthew; Mitchell, Michael David
2011-11-01
Infrastructures are networks of dynamically interacting systems designed for the flow of information, energy, and materials. Under certain circumstances, disturbances from a targeted attack or natural disasters can cause cascading failures within and between infrastructures that result in significant service losses and long recovery times. Reliable interdependency models that can capture such multi-network cascading do not exist. The research reported here has extended Sandia's infrastructure modeling capabilities by: (1) addressing interdependencies among networks, (2) incorporating adaptive behavioral models into the network models, and (3) providing mechanisms for evaluating vulnerability to targeted attack and unforeseen disruptions. We have applied these capabilities to evaluate the robustness of various systems, and to identify factors that control the scale and duration of disruption. This capability lays the foundation for developing advanced system security solutions that encompass both external shocks and internal dynamics.
The Theory of Variances in Equilibrium Reconstruction
Zakharov, Leonid E.; Lewandowski, Jerome; Foley, Elizabeth L.; Levinton, Fred M.; Yuh, Howard Y.; Drozdov, Vladimir; McDonald, Darren
2008-01-14
The theory of variances of equilibrium reconstruction is presented. It complements existing practices with information regarding what kind of plasma profiles can be reconstructed, how accurately, and what remains beyond the abilities of diagnostic systems. The #27;σ-curves, introduced by the present theory, give a quantitative assessment of quality of effectiveness of diagnostic systems in constraining equilibrium reconstructions. The theory also suggests a method for aligning the accuracy of measurements of different physical nature.
Reliable Viscosity Calculation from Equilibrium Molecular Dynamics
U.S. Department of Energy (DOE) all webpages (Extended Search)
Simulations: A Time Decomposition Method - Joint Center for Energy Storage Research July 7, 2015, Research Highlights Reliable Viscosity Calculation from Equilibrium Molecular Dynamics Simulations: A Time Decomposition Method Schematic demonstration of the time decomposition method Scientific Achievement An equilibrium molecular dynamics-based computational method is developed and tested for the reliable calculation of viscosity. Significance and Impact Viscosity is one of the key properties
Edge Equilibrium Code (EEC) For Tokamaks
Li, Xujling
2014-02-24
The edge equilibrium code (EEC) described in this paper is developed for simulations of the near edge plasma using the finite element method. It solves the Grad-Shafranov equation in toroidal coordinate and uses adaptive grids aligned with magnetic field lines. Hermite finite elements are chosen for the numerical scheme. A fast Newton scheme which is the same as implemented in the equilibrium and stability code (ESC) is applied here to adjust the grids
U.S. Department of Energy (DOE) all webpages (Extended Search)
Table for 10He is subdivided into the following categories: Theoretical Shell Model Cluster Model Other Models Special States Electromagnetic Transitions The General Table for...
U.S. Department of Energy (DOE) all webpages (Extended Search)
The General Table for 9Li is subdivided into the following categories: Shell Model Cluster Model Theoretical Ground State Properties Special States Other Model Calculations...
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Be General Tables The General Table for 8Be is subdivided into the following categories: Reviews Ground State Properties Shell Model Cluster Model Other Models Photodisintegration Fission and Fusion Astrophysical b-decay Hypernuclei
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B General Table The General Table for 9B is subdivided into the following categories: Shell Model Cluster Model Theoretical Other Model Calculations Complex Reactions Beta-Decay Pions Light-ion and Neutron Induced Reactions Hypernuclei
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C General Table The General Table for 9C is subdivided into the following categories: Shell Model Cluster Model Other Models Theoretical Beta-Decay Light-ion and Neutron Induced Reactions Astrophysical
Fedorov, Alexey V.; Fedorov, Alexey
2015-01-14
The central goal of this research project was to understand the mechanisms of decadal and multi-decadal variability of the Atlantic Meridional Overturning Circulation (AMOC) as related to climate variability and abrupt climate change within a hierarchy of climate models ranging from realistic ocean models to comprehensive Earth system models. Generalized Stability Analysis, a method that quantifies the transient and asymptotic growth of perturbations in the system, is one of the main approaches used throughout this project. The topics we have explored range from physical mechanisms that control AMOC variability to the factors that determine AMOC predictability in the Earth system models, to the stability and variability of the AMOC in past climates.
Frank, William M.; Hack, James J.; Kiehl, Jeffrey T.
1997-02-24
Research on designing an integrated moist process parameterization package was carried. This work began with a study that coupled an ensemble of cloud models to a boundary layer model to examine the feasibility of such a methodology for linking boundary layer and cumulus parameterization schemes. The approach proved feasible, prompting research to design and evaluate a coupled parameterization package for GCMS. This research contributed to the development of an Integrated Cumulus Ensemble-Turbulence (ICET) parameterization package. This package incorporates a higher-order turbulence boundary layer that feeds information concerning updraft properties and the variances of temperature and water vapor to the cloud parameterizations. The cumulus ensemble model has been developed, and initial sensitivity tests have been performed in the single column model (SCM) version of CCM2. It is currently being coupled to a convective wake/gust front model. The major function of the convective wake/gust front model is to simulate the partitioning of the boundary layer into disturbed and undisturbed regions. A second function of this model is to predict the nonlinear enhancement of surface to air sensible heat and moisture fluxes that occur in convective regimes due to correlations between winds and anomalously cold, dry air from downdrafts in the gust front region. The third function of the convective wake/gust front model is to predict the amount of undisturbed boundary layer air lifted by the leading edge of the wake and the height to which this air is lifted. The development of the wake/gust front model has been completed, and it has done well in initial testing as a stand-alone component. The current task, to be completed by the end of the funding period, is to tie the wake model to a cumulus ensemble model and to install both components into the single column model version of CCM3 for evaluation. Another area of parametrization research has been focused on the representation
Cloud/Aerosol Parameterizations: Application and Improvement of General Circulation Models
Penner, Joyce
2012-06-30
One of the biggest uncertainties associated with climate models and climate forcing is the treatment of aerosols and their effects on clouds. The effect of aerosols on clouds can be divided into two components: The first indirect effect is the forcing associated with increases in droplet concentrations; the second indirect effect is the forcing associated with changes in liquid water path, cloud morphology, and cloud lifetime. Both are highly uncertain. This project applied a cloud-resolving model to understand the response of clouds under a variety of conditions to changes in aerosols. These responses are categorized according to the large-scale meteorological conditions that lead to the response. Meteorological conditions were sampled from various fields, which, together with a global aerosol model determination of the change in aerosols from present day to pre-industrial conditions, was used to determine a first order estimate of the response of global cloud fields to changes in aerosols. The response of the clouds in the NCAR CAM3 GCM coupled to our global aerosol model were tested by examining whether the response is similar to that of the cloud resolving model and methods for improving the representation of clouds and cloud/aerosol interactions were examined.
Characterization of non equilibrium effects on high quality critical flows
Camelo, E.; Lemonnier, H.; Ochterbeck, J.
1995-09-01
The appropriate design of various pieces of safety equipment such as relief systems, relies on the accurate description of critical flow phenomena. Most of the systems of industrial interest are willing to be described by one-dimensional area-averaged models and a large fraction of them involves multi-component high gas quality flows. Within these circumstances, the flow is very likely to be of an annular dispersed nature and its description by two-fluid models requires various closure relations. Among the most sensitive closures, there is the interfacial area and the liquid entrained fraction. The critical flowrate depends tremendously on the accurate description of the non equilibrium which results from the correctness of the closure equations. In this study, two-component flows are emphasized and non equilibrium results mainly form the differences in the phase velocities. It is therefore of the utmost importance to have reliable data to characterize non equilibrium phenomena and to assess the validity of the closure models. A comprehensive description of air-water nozzle flows, with emphasis on the effect of the nozzle geometry, has been undertaken and some of the results are presented here which helps understanding the overall flow dynamics. Besides the critical flowrate, the presented material includes pressure profiles, droplet size and velocity, liquid film flowrate and liquid film thickness.
Agarwala, R. [National Institutes of Health, Bethesda, MD (United States); Batzoglou, S. [MIT Lab. for Computer Science, Cambridge, MA (United States); Dancik, V. [Univ. of Southern California, Los Angeles, CA (United States)] [and others
1997-12-01
A long standing problem in molecular biology is to determine the three-dimensional structure of a protein, given its amino acid sequence. A variety of simplifying models have been proposed abstracting only the {open_quotes}essential physical properties{close_quotes} of real proteins. In these models, the three dimensional space is often represented by a lattice. Residues which are adjacent in the primary sequence (i.e. covalently linked) must be placed at adjacent points in the lattice. A conformation of a protein is simply a self-avoiding walk along the lattice. The protein folding problem STRING-FOLD is that of finding a conformation of the protein sequence on the lattice such that the overall energy is minimized, for some reasonable definition of energy. This formulation leaves open the choices of a lattice and an energy function. Once these choices are made, one may then address the algorithmic complexity of optimizing the energy function for the lattice. For a variety of such simple models, this minimization problem is in fact NP-hard. In this paper, we consider the Hydrophobic-Polar (HP) Model introduced by Dill. The HP model abstracts the problem by grouping the 20 amino acids into two classes: hydrophobic (or non-polar) residues and hydrophilic (or polar) residues. For concreteness, we will take our input to be a string from (H,P){sup +}, where P represents polar residues, and H represents hydrophobic residues. Dill et.al. survey the literature analyzing this model. 8 refs., 2 figs., 1 tab.
U.S. Department of Energy (DOE) all webpages (Extended Search)
He General Table The General Table for 7He is subdivided into the following categories: Experimental Theoretical Model Calculations Hypernuclei and Mesons Pions
Near equilibrium distributions for beams with space charge in...
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Near equilibrium distributions for beams with space charge in linear and nonlinear periodic focusing systems Citation Details In-Document Search Title: Near equilibrium ...
Effects of the magnetic equilibrium on gyrokinetic simulations...
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Effects of the magnetic equilibrium on gyrokinetic simulations of tokamak ... Title: Effects of the magnetic equilibrium on gyrokinetic simulations of tokamak ...
Diluted equilibrium sterile neutrino dark matter (Journal Article...
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Diluted equilibrium sterile neutrino dark matter Citation Details In-Document Search This content will become publicly available on November 5, 2016 Title: Diluted equilibrium ...
Diluted equilibrium sterile neutrino dark matter (Journal Article...
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Diluted equilibrium sterile neutrino dark matter This content will become publicly available on November 5, 2016 Prev Next Title: Diluted equilibrium sterile neutrino dark ...
Weyermann, D.L.; Fight, R.D.; Garrett, F.D.
1991-08-01
This paper instructs resource analysts on using the southeast Alaska multiresource model (SAMM). SAMM is an interactive microcomputer program that allows users to explore relations among several resources in southeast Alaska (timber, anadromous fish, deer, and hydrology) and the effects of timber management activities (logging, thinning, and road building) on those relations and resources. This guide assists users in installing SAMM on a microcomputer, developing input data files, making simulation runs, and strong output data for external analysis and graphic display.
Bottom-up coarse-grained models that accurately describe the...
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the CG models accurately reproduce the equilibrium density, compressibility, and average ... CORRELATIONS; DENSITY; ENERGY DENSITY; EQUILIBRIUM; FLUCTUATIONS; HEPTANE; LIQUIDS; ...
Boltzmann equation solver adapted to emergent chemical non-equilibrium
Birrell, Jeremiah; Wilkening, Jon; Rafelski, Johann
2015-01-15
We present a novel method to solve the spatially homogeneous and isotropic relativistic Boltzmann equation. We employ a basis set of orthogonal polynomials dynamically adapted to allow for emergence of chemical non-equilibrium. Two time dependent parameters characterize the set of orthogonal polynomials, the effective temperature T(t) and phase space occupation factor ?(t). In this first paper we address (effectively) massless fermions and derive dynamical equations for T(t) and ?(t) such that the zeroth order term of the basis alone captures the particle number density and energy density of each particle distribution. We validate our method and illustrate the reduced computational cost and the ability to easily represent final state chemical non-equilibrium by studying a model problem that is motivated by the physics of the neutrino freeze-out processes in the early Universe, where the essential physical characteristics include reheating from another disappearing particle component (e{sup }-annihilation)
U.S. Department of Energy (DOE) all webpages (Extended Search)
7 General Tables The General Table for 7He is subdivided into the following categories: Experimental Theoretical Model Calculations Hypernuclei and Mesons Pions The General Table for 7Li is subdivided into the following categories: Reviews Ground State Properties Shell Model Cluster Model Other Theoretical Work Model Calculations Photodisintegration Polarization Fission and Fusion Elastic and Inelastic Scattering Projectile Fragmentation and Multifragmentation Astrophysical Hyperfine Structure
MacKinnon, R.J.; Sullivan, T.M.; Kinsey, R.R.
1997-05-01
The BLT-EC computer code has been developed, implemented, and tested. BLT-EC is a two-dimensional finite element computer code capable of simulating the time-dependent release and reactive transport of aqueous phase species in a subsurface soil system. BLT-EC contains models to simulate the processes (container degradation, waste-form performance, transport, chemical reactions, and radioactive production and decay) most relevant to estimating the release and transport of contaminants from a subsurface disposal system. Water flow is provided through tabular input or auxiliary files. Container degradation considers localized failure due to pitting corrosion and general failure due to uniform surface degradation processes. Waste-form performance considers release to be limited by one of four mechanisms: rinse with partitioning, diffusion, uniform surface degradation, and solubility. Transport considers the processes of advection, dispersion, diffusion, chemical reaction, radioactive production and decay, and sources (waste form releases). Chemical reactions accounted for include complexation, sorption, dissolution-precipitation, oxidation-reduction, and ion exchange. Radioactive production and decay in the waste form is simulated. To improve the usefulness of BLT-EC, a pre-processor, ECIN, which assists in the creation of chemistry input files, and a post-processor, BLTPLOT, which provides a visual display of the data have been developed. BLT-EC also includes an extensive database of thermodynamic data that is also accessible to ECIN. This document reviews the models implemented in BLT-EC and serves as a guide to creating input files and applying BLT-EC.
Prevosto, L.; Mancinelli, B.; Artana, G.; Kelly, H.
2011-03-15
A two-wavelength quantitative Schlieren technique that allows inferring the electron and gas densities of axisymmetric arc plasmas without imposing any assumption regarding statistical equilibrium models is reported. This technique was applied to the study of local thermodynamic equilibrium (LTE) departures within the core of a 30 A high-energy density cutting arc. In order to derive the electron and heavy particle temperatures from the inferred density profiles, a generalized two-temperature Saha equation together with the plasma equation of state and the quasineutrality condition were employed. Factors such as arc fluctuations that influence the accuracy of the measurements and the validity of the assumptions used to derive the plasma species temperature were considered. Significant deviations from chemical equilibrium as well as kinetic equilibrium were found at elevated electron temperatures and gas densities toward the arc core edge. An electron temperature profile nearly constant through the arc core with a value of about 14000-15000 K, well decoupled from the heavy particle temperature of about 1500 K at the arc core edge, was inferred.
Sonnad, Kiran G.; Cary, John R.
2015-04-15
A procedure to obtain a near equilibrium phase space distribution function has been derived for beams with space charge effects in a generalized periodic focusing transport channel. The method utilizes the Lie transform perturbation theory to canonically transform to slowly oscillating phase space coordinates. The procedure results in transforming the periodic focusing system to a constant focusing one, where equilibrium distributions can be found. Transforming back to the original phase space coordinates yields an equilibrium distribution function corresponding to a constant focusing system along with perturbations resulting from the periodicity in the focusing. Examples used here include linear and nonlinear alternating gradient focusing systems. It is shown that the nonlinear focusing components can be chosen such that the system is close to integrability. The equilibrium distribution functions are numerically calculated, and their properties associated with the corresponding focusing system are discussed.
Ivanov, A. A. Martynov, A. A. Medvedev, S. Yu. Poshekhonov, Yu. Yu.
2015-03-15
In the MHD tokamak plasma theory, the plasma pressure is usually assumed to be isotropic. However, plasma heating by neutral beam injection and RF heating can lead to a strong anisotropy of plasma parameters and rotation of the plasma. The development of MHD equilibrium theory taking into account the plasma inertia and anisotropic pressure began a long time ago, but until now it has not been consistently applied in computational codes for engineering calculations of the plasma equilibrium and evolution in tokamak. This paper contains a detailed derivation of the axisymmetric plasma equilibrium equation in the most general form (with arbitrary rotation and anisotropic pressure) and description of the specialized version of the SPIDER code. The original method of calculation of the equilibrium with an anisotropic pressure and a prescribed rotational transform profile is proposed. Examples of calculations and discussion of the results are also presented.
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He General Tables The General Table for 8He is subdivided into the following categories: Reviews Ground-state Properties Shell Model Cluster Model Other Theoretical Work Elastic and Inelastic Scattering b-decay
TMED-4 INTERIM REPORT PURE ZR EQUILIBRIUM TEST RESULTS
Korinko, P.; Morgan, G.
2010-12-17
Due to higher than expected permeation rates in the production of tritium in the TVA, a development and testing program was implemented to develop the understanding of why the higher rates were occurring. In addition, improved data are needed for both the design as well as the predictive models. One part of the program was to determine the equilibrium pressure of hydrogen and tritium over NPZ (1). During the course of this testing, some curious results were discovered (2) compared to the published literature data (3). Due to these apparently results, a follow-on task was undertaken to determine the equilibrium pressure of protium and deuterium over pure zirconium. A series of experiments were conducted to determine equilibrium pressures and isotherm data for the zirconium - protium and zirconium - deuterium systems. The data match the published literature data reasonably well with the plateau extending to loadings of about 1.4. There is a significant pressure rise for loadings greater than 1.7.
Chemical Equilibrium Composition of Aqueous Systems
Energy Science and Technology Software Center (OSTI)
1996-12-30
MINEQL is a subroutine package to calculate equilibrium composition of an aqueous system, accounting for mass transfer. MINEQL-EIR contains an additional base on enthalpy and heat capacity data and has the option to do calculations at temperatures different from 25 degrees C.
U.S. Department of Energy (DOE) all webpages (Extended Search)
subdivided into the following categories: Reviews Ground-State Properties Shell Model Cluster Model Other Theoretical Work These General Tables correspond to "Energy Levels of...
Transport and equilibrium in field-reversed mirrors
Boyd, J.K.
1982-09-01
Two plasma models relevant to compact torus research have been developed to study transport and equilibrium in field reversed mirrors. In the first model for small Larmor radius and large collision frequency, the plasma is described as an adiabatic hydromagnetic fluid. In the second model for large Larmor radius and small collision frequency, a kinetic theory description has been developed. Various aspects of the two models have been studied in five computer codes ADB, AV, NEO, OHK, RES. The ADB code computes two dimensional equilibrium and one dimensional transport in a flux coordinate. The AV code calculates orbit average integrals in a harmonic oscillator potential. The NEO code follows particle trajectories in a Hill's vortex magnetic field to study stochasticity, invariants of the motion, and orbit average formulas. The OHK code displays analytic psi(r), B/sub Z/(r), phi(r), E/sub r/(r) formulas developed for the kinetic theory description. The RES code calculates resonance curves to consider overlap regions relevant to stochastic orbit behavior.
Saenz, Juan A.; Chen, Qingshan; Ringler, Todd
2015-05-19
Recent work has shown that taking the thickness-weighted average (TWA) of the Boussinesq equations in buoyancy coordinates results in exact equations governing the prognostic residual mean flow where eddy–mean flow interactions appear in the horizontal momentum equations as the divergence of the Eliassen–Palm flux tensor (EPFT). It has been proposed that, given the mathematical tractability of the TWA equations, the physical interpretation of the EPFT, and its relation to potential vorticity fluxes, the TWA is an appropriate framework for modeling ocean circulation with parameterized eddies. The authors test the feasibility of this proposition and investigate the connections between the TWA framework and the conventional framework used in models, where Eulerian mean flow prognostic variables are solved for. Using the TWA framework as a starting point, this study explores the well-known connections between vertical transfer of horizontal momentum by eddy form drag and eddy overturning by the bolus velocity, used by Greatbatch and Lamb and Gent and McWilliams to parameterize eddies. After implementing the TWA framework in an ocean general circulation model, we verify our analysis by comparing the flows in an idealized Southern Ocean configuration simulated using the TWA and conventional frameworks with the same mesoscale eddy parameterization.
Saenz, Juan A.; Chen, Qingshan; Ringler, Todd
2015-05-19
Recent work has shown that taking the thickness-weighted average (TWA) of the Boussinesq equations in buoyancy coordinates results in exact equations governing the prognostic residual mean flow where eddy–mean flow interactions appear in the horizontal momentum equations as the divergence of the Eliassen–Palm flux tensor (EPFT). It has been proposed that, given the mathematical tractability of the TWA equations, the physical interpretation of the EPFT, and its relation to potential vorticity fluxes, the TWA is an appropriate framework for modeling ocean circulation with parameterized eddies. The authors test the feasibility of this proposition and investigate the connections between the TWAmore » framework and the conventional framework used in models, where Eulerian mean flow prognostic variables are solved for. Using the TWA framework as a starting point, this study explores the well-known connections between vertical transfer of horizontal momentum by eddy form drag and eddy overturning by the bolus velocity, used by Greatbatch and Lamb and Gent and McWilliams to parameterize eddies. After implementing the TWA framework in an ocean general circulation model, we verify our analysis by comparing the flows in an idealized Southern Ocean configuration simulated using the TWA and conventional frameworks with the same mesoscale eddy parameterization.« less
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He General Table The General Table for 5He is subdivided into the following categories: Ground State Properties Theoretical Special States Model Discussions Shell Model Cluster Model Complex Reactions Astrophysics Model Calculations Light-ion and Neutron Induced Reactions Electron Scattering Muon Catalyzed Fusion Other Fusion Photodisintegration Polarization Pions Hypernuclei
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He General Table The General Table for 6He is subdivided into the following categories: Ground State Properties Theoretical Special States Shell Model Cluster and alpha-particle Models Other Models Model Calculations Complex Reactions Involving 6He Electromagnetic Transitions Muon and Neutrino Capture and Reactions Reactions Involving pions, Other Mesons and Baryon States Photodisintegration Astrophysics Hypernuclei
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ON MOLECULAR HYDROGEN FORMATION AND THE MAGNETOHYDROSTATIC EQUILIBRIUM OF SUNSPOTS
Jaeggli, S. A.; Lin, H.; Uitenbroek, H.
2012-02-01
We have investigated the problem of sunspot magnetohydrostatic equilibrium with comprehensive IR sunspot magnetic field survey observations of the highly sensitive Fe I lines at 15650 A and nearby OH lines. We have found that some sunspots show isothermal increases in umbral magnetic field strength which cannot be explained by the simplified sunspot model with a single-component ideal gas atmosphere assumed in previous investigations. Large sunspots universally display nonlinear increases in magnetic pressure over temperature, while small sunspots and pores display linear behavior. The formation of molecules provides a mechanism for isothermal concentration of the umbral magnetic field, and we propose that this may explain the observed rapid increase in umbral magnetic field strength relative to temperature. Existing multi-component sunspot atmospheric models predict that a significant amount of molecular hydrogen (H{sub 2}) exists in the sunspot umbra. The formation of H{sub 2} can significantly alter the thermodynamic properties of the sunspot atmosphere and may play a significant role in sunspot evolution. In addition to the survey observations, we have performed detailed chemical equilibrium calculations with full consideration of radiative transfer effects to establish OH as a proxy for H{sub 2}, and demonstrate that a significant population of H{sub 2} exists in the coolest regions of large sunspots.
Out-of-Equilibrium Kondo Effect in Double Quantum Dots
Aguado, Ramon; Langreth, David C.
2000-08-28
The out-of-equilibrium transport properties of a double quantum dot system in the Kondo regime are studied theoretically by means of a two-impurity Anderson Hamiltonian with interimpurity hopping. The Hamiltonian is solved by means of a nonequilibrium generalization of the slave-boson mean-field theory. It is demonstrated that measurements of the differential conductance dI/dV , for appropriate values of voltages and tunneling couplings, can give a direct observation of the coherent superposition between the many-body Kondo states of each dot. For large voltages and arbitrarily large interdot tunneling, there is a critical voltage above which the physical behavior of the system again resembles that of two decoupled quantum dots. (c) 2000 The American Physical Society.
Nuclear Reactions X-Sections By Evaporation Model, Gamma-Cascades
Energy Science and Technology Software Center (OSTI)
2000-06-27
Calculation of energy-averaged cross sections for nuclear reactions with emission of particles and gamma rays and fission. The models employed are the evaporation model with inclusion of pre-equilibrium decay and gamma ray cascade model. Angular momentum and parity conservation are accounted for. Major improvement to the 1976 STAPRE program (NEA 0461) relates to level density approach, implemwnted in subroutine ZSTDE. Generalized superfluid model is incorporated, Boltzman-gas modelling of intrinsic state density and semi-empirical modelling ofmore » a few quasiparticle effects in total level density in equilibrium and saddle deformations of actinide nuclei.« less
Secular equilibrium of radium in Western coal
Casella, V.R.; Fleissner, J.G.; Styron, C.E.
1980-01-01
Concentrations of radium-226, radium-228, and thorium-228 in coal from six Western states have been measured by gamma spectroscopy. The existence of secular equilibrium was verified for radium-226 and previously measured uranium-238 and also for radium-228 and thorium-228. The measured radionuclide concentrations for Western coal averaged about 0.3 pCi/g for radium-226 and 0.2 pCi/g for radium-228 and thorium-228. These average values are not greatly different from those in coal from other provinces of the United States.
Process for operating equilibrium controlled reactions
Nataraj, Shankar; Carvill, Brian Thomas; Hufton, Jeffrey Raymond; Mayorga, Steven Gerard; Gaffney, Thomas Richard; Brzozowski, Jeffrey Richard
2001-01-01
A cyclic process for operating an equilibrium controlled reaction in a plurality of reactors containing an admixture of an adsorbent and a reaction catalyst suitable for performing the desired reaction which is operated in a predetermined timed sequence wherein the heating and cooling requirements in a moving reaction mass transfer zone within each reactor are provided by indirect heat exchange with a fluid capable of phase change at temperatures maintained in each reactor during sorpreaction, depressurization, purging and pressurization steps during each process cycle.
Neoclassical toroidal viscosity in perturbed equilibria with general tokamak geometry
Logan, Nikolas C.; Park, Jong-Kyu; Kim, Kimin; Wang, Zhirui; Berkery, John W.
2013-12-15
This paper presents a calculation of neoclassical toroidal viscous torque independent of large-aspect-ratio expansions across kinetic regimes. The Perturbed Equilibrium Nonambipolar Transport (PENT) code was developed for this purpose, and is compared to previous combined regime models as well as regime specific limits and a drift kinetic ?f guiding center code. It is shown that retaining general expressions, without circular large-aspect-ratio or other orbit approximations, can be important at experimentally relevant aspect ratio and shaping. The superbanana plateau, a kinetic resonance effect recently recognized for its relevance to ITER, is recovered by the PENT calculations and shown to require highly accurate treatment of geometric effects.
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Li General Table The General Table for 6Li is subdivided into the following categories: Ground State Properties of 6Li Special States Theoretical Shell Model Cluster Models Complex Reactions Involving 6Li Model Calculations Electromagnetic Transitions Muon and Neutrino Capture and Reactions Reactions Involving Pions, Other Mesons and Baryon States Light-ion and Neutron Induced Reactions Pions Hypernuclei Reactions Involving Antiprotons Astrophysics
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Be General Table The General Table for 7Be is subdivided into the following categories: Reviews Experimental Work Shell Model Cluster Model Other Theoretical Work Model Calculations Projectile Fragmentation and Multifragmentation Astrophysical b Decay Astrophysical Neutrinos Hypernuclei, Mesons and Other Exotic Particles Applications
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Li General Table The General Table for 7Li is subdivided into the following categories: Reviews Ground State Properties Shell Model Cluster Model Other Theoretical Work Model Calculations Photodisintegration Polarization Fission and Fusion Elastic and Inelastic Scattering Projectile Fragmentation and Multifragmentation Astrophysical Hyperfine Structure b-decay Muons Hypernuclei and Mesons Hypernuclei and Baryons Pion, Kaon and Eta-Mesons Other Work Applications
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B General Tables The General Table for 8B is subdivided into the following categories: Reviews Ground State Properties Shell Model Cluster Model Other Models Photodisintegration and Coulomb Dissociation Elastic and Inelastic Scattering Fragmentation Reactions Astrophysical b Decay Nucleon Spatial Distribution
U.S. Department of Energy (DOE) all webpages (Extended Search)
Li General Tables The General Table for 8Li is subdivided into the following categories: Reviews Ground State Properties Shell Model Cluster Model Other Models Photodissociation Fusion and Fission Elastic and Inelastic Scattering Fragmentation Reactions Astrophysical b Decay Hypernuclei Pions, Kaons and h-mesons
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Li General Table The General Table for 9Li is subdivided into the following categories: Shell Model Cluster Model Theoretical Ground State Properties Special States Other Model Calculations Complex Reactions Beta-Decay Pions Muons Photodisintegration Elastic and Inelastic Scattering Electromagnetic Transitions Astrophysical
Non-equilibrium many body dynamics
Creutz, M.; Gyulassy, M.
1997-09-22
This Riken BNL Research Center Symposium on Non-Equilibrium Many Body Physics was held on September 23-25, 1997 as part of the official opening ceremony of the Center at Brookhaven National Lab. A major objective of theoretical work at the center is to elaborate on the full spectrum of strong interaction physics based on QCD, including the physics of confinement and chiral symmetry breaking, the parton structure of hadrons and nuclei, and the phenomenology of ultra-relativistic nuclear collisions related to the up-coming experiments at RHIC. The opportunities and challenges of nuclear and particle physics in this area naturally involve aspects of the many body problem common to many other fields. The aim of this symposium was to find common theoretical threads in the area of non-equilibrium physics and modern transport theories. The program consisted of invited talks on a variety topics from the fields of atomic, condensed matter, plasma, astrophysics, cosmology, and chemistry, in addition to nuclear and particle physics. Separate abstracts have been indexed into the database for contributions to this workshop.
U.S. Department of Energy (DOE) all webpages (Extended Search)
Li General Table The General Table for 10Li is subdivided into the following categories: Reviews Theoretical Ground State Properties Shell Model Cluster Model Other Models Special States Astrophysical Electromagnetic Transitions Hypernuclei Photodisintegration Light-Ion and Neutron Induced Reactions These General Tables correspond to the 2003 preliminary evaluation of ``Energy Levels of Light Nuclei, A = 10''. The prepublication version of A = 10 is available on this website in PDF format: A =
Chen, Xin
2014-04-21
Understanding the roles of the temporary and spatial structures of quantum functional noise in open multilevel quantum molecular systems attracts a lot of theoretical interests. I want to establish a rigorous and general framework for functional quantum noises from the constructive and computational perspectives, i.e., how to generate the random trajectories to reproduce the kernel and path ordering of the influence functional with effective Monte Carlo methods for arbitrary spectral densities. This construction approach aims to unify the existing stochastic models to rigorously describe the temporary and spatial structure of Gaussian quantum noises. In this paper, I review the Euclidean imaginary time influence functional and propose the stochastic matrix multiplication scheme to calculate reduced equilibrium density matrices (REDM). In addition, I review and discuss the Feynman-Vernon influence functional according to the Gaussian quadratic integral, particularly its imaginary part which is critical to the rigorous description of the quantum detailed balance. As a result, I establish the conditions under which the influence functional can be interpreted as the average of exponential functional operator over real-valued Gaussian processes for open multilevel quantum systems. I also show the difference between the local and nonlocal phonons within this framework. With the stochastic matrix multiplication scheme, I compare the normalized REDM with the Boltzmann equilibrium distribution for open multilevel quantum systems.
Haywood, J.M.; Roberts, D.L.; Slingo, A.
1997-07-01
A new radiation code within a general circulation model is used to assess the direct solar and thermal radiative forcing by sulfate aerosol of anthropogenic origin and soot aerosol from fossil-fuel burning. The radiative effects of different aerosol profiles, relative humidity parameterizations, chemical compositions, and internal and external mixtures of the two aerosol types are investigated. The contribution to the radiative forcing from cloudy sky regions is found to be negligible for sulfate aerosol; this is in contrast to recent studies where the cloudy sky contribution was estimated using a method in which the spatial correlation between cloud amount and sulfate burden was ignored. However, the radiative forcing due to fossil-fuel soot aerosol is enhanced in cloudy regions if soot aerosol exists within or above the cloud. The global solar radiative forcing due to sulfate aerosol is estimated to be -0.38 W m{sup -2} and the global thermal radiative forcing is estimated to be +0.01 W m{sup -2}. The hemispheric mean radiative forcings vary by only about 10% for reasonable assumptions about the chemical form of the sulfate aerosol and the relative humidity dependence; the uncertainties in the aerosol loading are far more significant. If a soot/sulfate mass ratio of 0.075 is assumed, then the global solar radiative forcing weakens to -0.18 W m{sup -2} for an external mixture and weakens further for an internal mixture. Additionally, the spatial distribution of the radiative forcing shows strong negative/positive forcing contrasts that may influence the dynamical response of the atmosphere. Although these results are extremely sensitive to the adopted soot/sulfate ratio and the assumed vertical profile, they indicate that fossil-fuel soot aerosol may exert a nonnegligible radiative forcing and emphasize the need to consider each anthropogenic aerosol species. 58 refs., 8 figs., 1 tab.
Stabilization of beam-weibel instability by equilibrium density ripples
Mishra, S. K. Kaw, Predhiman; Das, A.; Sengupta, S.; Ravindra Kumar, G.
2014-01-15
In this paper, we present an approach to achieve suppression/complete stabilization of the transverse electromagnetic beam Weibel instability in counter streaming electron beams by modifying the background plasma with an equilibrium density ripple, shorter than the skin depth; this weakening is more pronounced when thermal effects are included. On the basis of a linear two stream fluid model, it is shown that the growth rate of transverse electromagnetic instabilities can be reduced to zero value provided certain threshold values for ripple parameters are exceeded. We point out the relevance of the work to recent experimental investigations on sustained (long length) collimation of fast electron beams and integral beam transport for laser induced fast ignition schemes, where beam divergence is suppressed with the assistance of carbon nano-tubes.
Expansion Potentials for Exact Far-from-Equilibrium Spreading of Particles and Energy
Vasseur, Romain; Karrasch, Christoph; Moore, Joel E.
2015-12-01
We report that the rates at which energy and particle densities move to equalize arbitrarily large temperature and chemical potential differences in an isolated quantum system have an emergent thermodynamical description whenever energy or particle current commutes with the Hamiltonian. Concrete examples include the energy current in the 1D spinless fermion model with nearest-neighbor interactions (XXZ spin chain), energy current in Lorentz-invariant theories or particle current in interacting Bose gases in arbitrary dimension. Even far from equilibrium, these rates are controlled by state functions, which we call "expansion potentials", expressed as integrals of equilibrium Drude weights. This relation between nonequilibrium quantities and linear response implies non-equilibrium Maxwell relations for the Drude weights. Lastly, we verify our results via DMRG calculations for the XXZ chain.
Expansion Potentials for Exact Far-from-Equilibrium Spreading of Particles and Energy
Vasseur, Romain; Karrasch, Christoph; Moore, Joel E.
2015-12-01
We report that the rates at which energy and particle densities move to equalize arbitrarily large temperature and chemical potential differences in an isolated quantum system have an emergent thermodynamical description whenever energy or particle current commutes with the Hamiltonian. Concrete examples include the energy current in the 1D spinless fermion model with nearest-neighbor interactions (XXZ spin chain), energy current in Lorentz-invariant theories or particle current in interacting Bose gases in arbitrary dimension. Even far from equilibrium, these rates are controlled by state functions, which we call "expansion potentials", expressed as integrals of equilibrium Drude weights. This relation between nonequilibriummore » quantities and linear response implies non-equilibrium Maxwell relations for the Drude weights. Lastly, we verify our results via DMRG calculations for the XXZ chain.« less
Fe Atomic Data for Non-equilibrium Ionization Plasmas Eriksen...
Office of Scientific and Technical Information (OSTI)
Fe Atomic Data for Non-equilibrium Ionization Plasmas Eriksen, Kristoffer A. Los Alamos National Laboratory; Fontes, Christopher J. Los Alamos National Laboratory; Colgan,...
Non-equilibrium tunneling in zigzag graphene nanoribbon break...
Office of Scientific and Technical Information (OSTI)
Spintronic devices promise new faster and lower energy-consumption electronic systems. ... In this paper, by utilizing density functional theory and non-equilibrium green function ...
Electron Broadening of Isolated Lines with Stationary Non-Equilibrium...
Office of Scientific and Technical Information (OSTI)
Title: Electron Broadening of Isolated Lines with Stationary Non-Equilibrium Level Populations It is shown that a quantum kinetic theory approach to line broadening, extended to ...
Free boundary, high beta equilibrium in a large aspect ratio...
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The equilibrium solution also provides information on the flux surface topology. The plasma is bounded by a separatrix. Increasing the plasma pressure at fixed total current causes ...
Equilibrium Control Policies for Markov Chains
Malikopoulos, Andreas
2011-01-01
The average cost criterion has held great intuitive appeal and has attracted considerable attention. It is widely employed when controlling dynamic systems that evolve stochastically over time by means of formulating an optimization problem to achieve long-term goals efficiently. The average cost criterion is especially appealing when the decision-making process is long compared to other timescales involved, and there is no compelling motivation to select short-term optimization. This paper addresses the problem of controlling a Markov chain so as to minimize the average cost per unit time. Our approach treats the problem as a dual constrained optimization problem. We derive conditions guaranteeing that a saddle point exists for the new dual problem and we show that this saddle point is an equilibrium control policy for each state of the Markov chain. For practical situations with constraints consistent to those we study here, our results imply that recognition of such saddle points may be of value in deriving in real time an optimal control policy.
Van Gorder, Robert A.
2014-11-15
In R. A. Van Gorder, General rotating quantum vortex filaments in the low-temperature Svistunov model of the local induction approximation, Phys. Fluids 26, 065105 (2014) I discussed properties of generalized vortex filaments exhibiting purely rotational motion under the low-temperature Svistunov model of the local induction approximation. Such solutions are stationary in terms of translational motion. In the Comment [N. Hietala, Comment on General rotating quantum vortex filaments in the low-temperature Svistunov model of the local induction approximation [Phys. Fluids 26, 065105 (2014)], Phys. Fluids 26, 119101 (2014)], the author criticizes my paper for not including translational motion (although it was clearly stated that the filament motion was assumed rotational). As it turns out, if one is interested in studying the geometric structure of solutions (which was the point of my paper), one obtains the needed qualitative results on the structure of such solutions by studying the purely rotational case. Nevertheless, in this Response I shall discuss the vortex filaments that have both rotational and translational motions. I then briefly discuss why one might want to study such generalized rotating filament solutions, in contrast to simple the standard helical or planar examples (which are really special cases). I also discuss how one can study the time evolution of filaments which exhibit more complicated dynamics than pure translation and rotation. Doing this, one can study non-stationary solutions which initially appear purely rotational and gradually display other dynamics as the filaments evolve.
Tao, Wei-Kuo; Houze, Robert, A., Jr.; Zeng, Xiping
2013-03-14
This three-year project, in cooperation with Professor Bob Houze at University of Washington, has been successfully finished as planned. Both ARM (the Atmospheric Radiation Measurement Program) data and cloud-resolving model (CRM) simulations were used to identify the water budgets of clouds observed in two international field campaigns. The research results achieved shed light on several key processes of clouds in climate change (or general circulation models), which are summarized below. 1. Revealed the effect of mineral dust on mesoscale convective systems (MCSs) Two international field campaigns near a desert and a tropical coast provided unique data to drive and evaluate CRM simulations, which are TWP-ICE (the Tropical Warm Pool International Cloud Experiment) and AMMA (the African Monsoon Multidisciplinary Analysis). Studies of the two campaign data were contrasted, revealing that much mineral dust can bring about large MCSs via ice nucleation and clouds. This result was reported as a PI presentation in the 3rd ASR Science Team meeting held in Arlington, Virginia in March 2012. A paper on the studies was published in the Journal of the Atmospheric Sciences (Zeng et al. 2013). 2. Identified the effect of convective downdrafts on ice crystal concentration Using the large-scale forcing data from TWP-ICE, ARM-SGP (the Southern Great Plains) and other field campaigns, Goddard CRM simulations were carried out in comparison with radar and satellite observations. The comparison between model and observations revealed that convective downdrafts could increase ice crystal concentration by up to three or four orders, which is a key to quantitatively represent the indirect effects of ice nuclei, a kind of aerosol, on clouds and radiation in the Tropics. This result was published in the Journal of the Atmospheric Sciences (Zeng et al. 2011) and summarized in the DOE/ASR Research Highlights Summaries (see http://www.arm.gov/science/highlights/RMjY5/view). 3. Used radar
U.S. Energy Information Administration (EIA) (indexed site)
General Engineers The U.S. Energy Information Administration (EIA) within the Department of Energy has forged a world-class information program that stresses quality, teamwork, and employee growth. In support of our program, we offer a variety of profes- sional positions, including the General Engineer, whose work is associated with analytical studies and evaluation projects pertaining to the operations of the energy industry. Responsibilities: General Engineers perform or participate in one or
On the equilibrium shape of erythrocytes
Marchenko, V. I. Podolyak, E. R.
2015-04-15
It is shown that the model proposed by Canham quantitatively describes the observed biconcave shape of human erythrocytes.
Helali, H.; Bchir, T.; Araoud, Z.; Charrada, K.
2013-04-15
The aim of this work is to study the local thermodynamic equilibrium (LTE) deviations in arc discharges plasma generated in high-intensity discharge lamps operating under an ac (50 Hz) power supply. To achieve this goal, we elaborate a two-temperature, two-dimensional, and time-depending model. We have found numerical results almost reproducing the experimental data, which allows us to validate this model. After validation, we have discussed different energy term effects on the LTE deviations.
Malolepsza, Edyta; Kim, Jaegil; Keyes, Tom
2015-04-28
Metastable β ice holds small guest molecules in stable gas hydrates, so its solid/liquid equilibrium is of interest. However, aqueous crystal/liquid transitions are very difficult to simulate. A new MD algorithm generates trajectories in a generalized NPT ensemble and equilibrates states of coexisting phases with a selectable enthalpy. Furthermore, with replicas spanning the range between β ice and liquid water we find the statistical temperature from the enthalpy histograms and characterize the transition by the entropy, introducing a general computational procedure for first-order transitions.
Modeling non-equilibrium phase transitions in isentropically...
Office of Scientific and Technical Information (OSTI)
The pressure drive is deduced by back integration of VISAR data from shots performed with Al samples. Authors: Kane, J ; Smith, R Publication Date: 2005-09-19 OSTI Identifier: ...
Modeling non-equilibrium phase transitions in isentropically...
Office of Scientific and Technical Information (OSTI)
In the experiments, the Bi samples are attached to windows of LiF or sapphire, and the velocity history of the sample-window interface is recorded with line VISAR. The 1D response ...
Hietala, Niklas Hnninen, Risto
2014-11-15
Van Gorder considers a formulation of the local induction approximation, which allows the vortex to move in the direction of the reference axis [General rotating quantum vortex filaments in the low-temperature Svistunov model of the local induction approximation, Phys. Fluids 26, 065105 (2014)]. However, in his analytical and numerical study he does not use it. A mistake in the torsion of a helical vortex is also corrected.
Phase-field investigation on the non-equilibrium interface dynamics of rapid alloy solidification
Choi, Jeong
2011-08-15
The research program reported here is focused on critical issues that represent conspicuous gaps in current understanding of rapid solidification, limiting our ability to predict and control microstructural evolution (i.e. morphological dynamics and microsegregation) at high undercooling, where conditions depart significantly from local equilibrium. More specifically, through careful application of phase-field modeling, using appropriate thin-interface and anti-trapping corrections and addressing important details such as transient effects and a velocity-dependent (i.e. adaptive) numerics, the current analysis provides a reasonable simulation-based picture of non-equilibrium solute partitioning and the corresponding oscillatory dynamics associated with single-phase rapid solidification and show that this method is a suitable means for a self-consistent simulation of transient behavior and operating point selection under rapid growth conditions. Moving beyond the limitations of conventional theoretical/analytical treatments of non-equilibrium solute partitioning, these results serve to substantiate recent experimental findings and analytical treatments for single-phase rapid solidification. The departure from the equilibrium solid concentration at the solid-liquid interface was often observed during rapid solidification, and the energetic associated non-equilibrium solute partitioning has been treated in detail, providing possible ranges of interface concentrations for a given growth condition. Use of these treatments for analytical description of specific single-phase dendritic and cellular operating point selection, however, requires a model for solute partitioning under a given set of growth conditions. Therefore, analytical solute trapping models which describe the chemical partitioning as a function of steady state interface velocities have been developed and widely utilized in most of the theoretical investigations of rapid solidification. However, these
This position is located in Office of Standard Contract Management, within the Office of the General Counsel (GC). The purpose of the position is to conduct technical and engineering reviews of the...
The equilibrium of neural firing: A mathematical theory
Lan, Sizhong
2014-12-15
Inspired by statistical thermodynamics, we presume that neuron system has equilibrium condition with respect to neural firing. We show that, even with dynamically changeable neural connections, it is inevitable for neural firing to evolve to equilibrium. To study the dynamics between neural firing and neural connections, we propose an extended communication system where noisy channel has the tendency towards fixed point, implying that neural connections are always attracted into fixed points such that equilibrium can be reached. The extended communication system and its mathematics could be useful back in thermodynamics.
Tax reform and energy in the Philippines economy: A general equilibrium computation
Boyd, R.G.; Doroodian, K.; Udomvaech, P.
1994-12-31
This paper examines how energy tax cuts, offset with income tax increases, affect production, consumption, and total welfare in the Philippines economy. Our results show that energy tax cuts expand the energy and nonmetal mining sectors, but decrease output in the manufacturing, agricultural, and metal mining sectors. Consumption of all goods and services combined increases as the amount of energy tax reduction increases. Our welfare results, however, are mixed. While the welfare of the mid- and high-income levels increases, that of the lowest income level decreases. These results are robust with respect to changes in the elasticity of substitution in energy production as well as the elasticity of substitution in consumer demand. From the standpoint of economic efficiency, a policy such as this would enhance growth and aggregate income. From an equity standpoint, however, this policy is highly regressive in spite of the fact that the richest households pay proportionately more to finance the energy tax reduction. 18 refs., 10 tabs.
Lifshutz, N.; Pierce, M.
1997-08-01
The CertiTest 8160 is a Condensation Nucleus Counter (CNC) based filtration test stand which permits measurement of penetration as a function of particle size. The Model 8140 is also a CNC based filtration test stand which provides a single penetration measurement for a fixed particle distribution aerosol challenge. A study was carried out measuring DOP penetration on a broad range of flat filtration media at various face velocities to compare these two instruments. The tests done on the CertiTest 8160 incorporated a range of particle sizes which encompassed the most penetrating particle size (MPPS). In this paper we present a correlation between the MPPS penetration as measured by the CertiTest 8160 and the penetration values obtained on the Model 8140. We observed that at the lowest air face velocities of the study the Model 8140 tended to overpredict the MPPS penetration as measured by the CertiTest 8160. We also present a correlation of MPPS penetration with face velocity which may be of use for extrapolation purposes. 5 refs., 8 figs.
Yu, Yiqun; Jordanova, Vania K.; Ridley, Aaron J.; Albert, Jay M.; Horne, Richard B.; Jeffery, Christopher A.
2016-09-17
Electron precipitation down to the atmosphere due to wave-particle scattering in the magnetosphere contributes significantly to the auroral ionospheric conductivity. In order to obtain the auroral conductivity in global MHD models that are incapable of capturing kinetic physics in the magnetosphere, MHD parameters are often used to estimate electron precipitation flux for the conductivity calculation. Such an MHD approach, however, lacks self-consistency in representing the magnetosphere-ionosphere coupling processes. In this study we improve the coupling processes in global models with a more physical method. We calculate the physics-based electron precipitation from the ring current and map it to the ionosphericmore » altitude for solving the ionospheric electrodynamics. In particular, we use the BATS-R-US (Block Adaptive Tree Scheme-Roe type-Upstream) MHD model coupled with the kinetic ring current model RAM-SCB (Ring current-Atmosphere interaction Model with Self-Consistent Magnetic field (B)) that solves pitch angle-dependent electron distribution functions, to study the global circulation dynamics during the 25–26 January 2013 storm event. Since the electron precipitation loss is mostly governed by wave-particle resonant scattering in the magnetosphere, we further investigate two loss methods of specifying electron precipitation loss associated with wave-particle interactions: (1) using pitch angle diffusion coefficients Dαα(E,α) determined from the quasi-linear theory, with wave spectral and plasma density obtained from statistical observations (named as “diffusion coefficient method”) and (2) using electron lifetimes τ(E) independent on pitch angles inferred from the above diffusion coefficients (named as “lifetime method”). We found that both loss methods demonstrate similar temporal evolution of the trapped ring current electrons, indicating that the impact of using different kinds of loss rates is small on the trapped electron population
Lin, Shian-Jiann; Chao, W.C.; Sud, Y.C.; Walker, G.K. )
1994-07-01
A generalized form of the second-order van Leer transport scheme is derived. Several constraints to the implied subgrid linear distribution are discussed. A very simple positive-definite scheme can be derived directly from the generalized form. A monotonic version of these scheme is applied to the Goddard Laboratory for Atmospheres (GLA) general circulation model (GCM) for the moisture transport calculations, replacing the original fourth-order center-differencing scheme. Comparisons with the original scheme are made in idealized tests as well as in a summer climate simulation using the full GLA GCM. A distinct advantage of the monotonic transport scheme is its ability to transport sharp gradients without producing spurious oscillations and unphysical negative mixing ratio. Within the context of low-resolution climate simulations, the aforementioned characteristics are demonstrated to be very beneficial in regions where cumulus convection is active. The model-produced precipitation pattern using the new transport scheme is more coherently organized both in time and in space, and correlates better with observations. The side effect of the filling algorithm used in conjunction with the original scheme is also discussed, in the context of idealized tests. The major weakness of the proposed transport scheme with a local monotonic constraint is its substantial implicit diffusion at low resolution. Alternative constraints are discussed to counter this problem. 34 refs., 13 figs., 1 tab.
Ganguly, A. E-mail: aganguly@maths.iitkgp.ernet.in; Das, A.
2014-11-15
We consider one-dimensional stationary position-dependent effective mass quantum model and derive a generalized Korteweg-de Vries (KdV) equation in (1+1) dimension through Lax pair formulation, one being the effective mass Schrödinger operator and the other being the time-evolution of wave functions. We obtain an infinite number of conserved quantities for the generated nonlinear equation and explicitly show that the new generalized KdV equation is an integrable system. Inverse scattering transform method is applied to obtain general solution of the nonlinear equation, and then N-soliton solution is derived for reflectionless potentials. Finally, a special choice has been made for the variable mass function to get mass-deformed soliton solution. The influence of position and time-dependence of mass and also of the different representations of kinetic energy operator on the nature of such solitons is investigated in detail. The remarkable features of such solitons are demonstrated in several interesting figures and are contrasted with the conventional KdV-soliton associated with constant-mass quantum model.
Van Gorder, Robert A.
2014-06-15
In his study of superfluid turbulence in the low-temperature limit, Svistunov [Superfluid turbulence in the low-temperature limit, Phys. Rev. B 52, 3647 (1995)] derived a Hamiltonian equation for the self-induced motion of a vortex filament. Under the local induction approximation (LIA), the Svistunov formulation is equivalent to a nonlinear dispersive partial differential equation. In this paper, we consider a family of rotating vortex filament solutions for the LIA reduction of the Svistunov formulation, which we refer to as the 2D LIA (since it permits a potential formulation in terms of two of the three Cartesian coordinates). This class of solutions holds the well-known Hasimoto-type planar vortex filament [H. Hasimoto, Motion of a vortex filament and its relation to elastica, J. Phys. Soc. Jpn. 31, 293 (1971)] as one reduction and helical solutions as another. More generally, we obtain solutions which are periodic in the space variable. A systematic analytical study of the behavior of such solutions is carried out. In the case where vortex filaments have small deviations from the axis of rotation, closed analytical forms of the filament solutions are given. A variety of numerical simulations are provided to demonstrate the wide range of rotating filament behaviors possible. Doing so, we are able to determine a number of vortex filament structures not previously studied. We find that the solution structure progresses from planar to helical, and then to more intricate and complex filament structures, possibly indicating the onset of superfluid turbulence.
Colbert, J.J.; Sheehan, K.A.
1995-08-16
This document describes the structure, organization, and mathematical formulations for the Stand-Damage Model and the Biological basis for these formulations. Growth, mortality, and regeneration are modeled along with the effects of user-prescribed defoliation and stand-management actions. The appendices provide a full description of the logic and mathematics in the form of code listings, structure charts, and files.
Fe Atomic Data for Non-equilibrium Ionization Plasmas (Conference) |
Office of Scientific and Technical Information (OSTI)
SciTech Connect Fe Atomic Data for Non-equilibrium Ionization Plasmas Citation Details In-Document Search Title: Fe Atomic Data for Non-equilibrium Ionization Plasmas No abstract prepared. Authors: Eriksen, Kristoffer A. [1] ; Fontes, Christopher J. [1] ; Colgan, James P. [1] ; Zhang, Honglin [1] ; Hungerford, Aimee L. [1] ; Fryer, Christopher L. [1] ; Hughes, John P. [2] ; Smith, Randall K. [3] ; Badenes, Carles [4] + Show Author Affiliations Los Alamos National Laboratory Rutgers
U.S. Department of Energy (DOE) all webpages (Extended Search)
GENERAL ASSIGNMENT KNOW ALL MEN BY THESE PRESENTS, that ___________________________________, a corporation organized and existing under the laws of the State of ________________________, with its principal place of business at ___________________________________, ___________________________________ has been engaged in performing work under Award Number DE-__________________________with the UNITED STATES OF AMERICA (hereinafter called the "Government"), represented by the UNITED STATES
Nishi, Sakine; Kobayashi, Tsutomu
2015-03-31
The galilean genesis scenario is an alternative to inflation in which the universe starts expanding from Minkowski in the asymptotic past by violating the null energy condition stably. Several concrete models of galilean genesis have been constructed so far within the context of galileon-type scalar-field theories. We give a generic, unified description of the galilean genesis scenario in terms of the Horndeski theory, i.e., the most general scalar-tensor theory with second-order field equations. In doing so we generalize the previous models to have a new parameter (denoted by α) which results in controlling the evolution of the Hubble rate. The background dynamics is investigated to show that the generalized galilean genesis solution is an attractor, similarly to the original model. We also study the nature of primordial perturbations in the generalized galilean genesis scenario. In all the models described by our generalized genesis Lagrangian, amplification of tensor perturbations does not occur as opposed to what happens in quasi-de Sitter inflation. We show that the spectral index of curvature perturbations is determined solely from the parameter α and does not depend on the other details of the model. In contrast to the original model, a nearly scale-invariant spectrum of curvature perturbations is obtained for a specific choice of α.
Kushnir, Y.; Esbensen, S.K.
1986-12-01
The energetics of large-scale disturbances of the wintertime, Northern Hemisphere circulation are studied with the OSU two-level general circulation model. The behavior of simulated eddies with short time-scale (2.5 to 10 days) is found to be consistent with observations and with baroclinic instability theory. Eddies with long time-scales (>10 days) appear to be maintained primarily by high-latitude baroclinic energy conversions. Energy conversions characteristic of barotropic processes are found at jet stream latitudes.
Gangwer, T
1980-01-01
A mechanism for coal liquefaction, based on the concept of thermal cleavage-hydrogen capping donor complexes, is proposed and the quantitative agreement between the derived rate laws and the kinetic data obtained from fifteen publications is presented. The mechanism provides rate laws which describe the preasphaltene, asphaltene, oil and gas time/yield curves for the coal liquefaction process. A simplistic dissolution model is presented and used to relate the proposed mechanism to the experimentally observed products. Based on the quality of the mechanistic fit to the reported coal liquefaction systems, which cover a diverse range of reaction conditions, coal types and donor solvent compositions, it is proposed that the donor solvent/thermal bond cleavage/hydrogen capping mechanism provides a good, quantitative description of the rate limiting process. Interpretation of the rate constant/temperature dependencies in terms of transition state theory indicates formation of the activated complex can involve either physically or chemically controlled steps. A uniform free energy of activation of 52 kcal was found for the diverse liquefaction systems indicating a common transition state describes the reactions. Thus the proposed mechanism unifies the diverse liquefaction kinetic data by using a set of uniform reaction sequences, which have a common transition state, to describe the conversion chemistry. The mechanism thereby creates a common base for intercomparison, interpretation and evaluation of coal conversion for the broad range of processes currently being investigated in the liquefaction field.
Boyle, J.S.
1994-11-01
Divergence and convergence centers at 200 hPa and mean sea level pressure (MSLP) cyclones were located every 6 hr for a 10-yr general circulation model (GCM) simulation with the ECMWF (Cycle 36) for the boreal winters from 1980 to 1988. The simulation used the observed monthly mean sea surface temperature (SST) for the decade. Analysis of the frequency, location, and strength of these centers and cyclones gives insight into the dynamical response of the model to the varying SST. The results indicate that (1) the model produces reasonable climatologies of upper-level divergence and MSLP cyclones; (2) the model distribution of anomalies of divergence and convergence centers and MSLP cyclones is consistent with observations for the 1982-83 and 1986-87 El Nifio events; (3) the tropical Indian Ocean is the region of greatest divergence activity and interannual variability in the model; (4) the variability of the divergence centers is greater than that of the convergence centers; (5) strong divergence centers occur chiefly over the ocean in the midlatitudes but are more land-based in the tropics, except in the Indian Ocean; and (6) locations of divergence and convergence centers can be a useful tool for the intercomparison of global atmospheric simulations.
On the nature of unstable equilibrium points in power systems
Berggren, B.; Andersson, G. . Dept. of Electric Power Systems)
1993-05-01
This paper concerns the application of direct methods for transient stability analysis of stressed power systems. One of the most important issues in this area is to find the controlling unstable equilibrium point for the disturbance under consideration. This paper provides a conceptual framework for discussing stable and unstable equilibrium points in power systems based on simple topological arguments. It is for instance shown that every conceivable case of system separation can be related to a specific unstable equilibrium point (u.e.p) in an unloaded system. This result can be seen as a verification of the soundness of the often used corrected corner point approximation and ray point approximation, since these two approximations would give the same unstable equilibrium points in an unloaded system. Moreover, it is shown, by an example, that some of these unstable equilibrium points can disappear when the loading of the system increases. The implications of the findings of this paper are discussed for the so-called MOD method of finding the controlling u.e.p., which is used in some software packages. Finally, a method based on a combination of MOD method and the BCU method is outlined and proposed as the subject of future investigation.
Criticism of generally accepted fundamentals and methodologies of traffic and transportation theory
Kerner, Boris S.
2015-03-10
It is explained why the set of the fundamental empirical features of traffic breakdown (a transition from free flow to congested traffic) should be the empirical basis for any traffic and transportation theory that can be reliable used for control and optimization in traffic networks. It is shown that generally accepted fundamentals and methodologies of traffic and transportation theory are not consistent with the set of the fundamental empirical features of traffic breakdown at a highway bottleneck. To these fundamentals and methodologies of traffic and transportation theory belong (i) Lighthill-Whitham-Richards (LWR) theory, (ii) the General Motors (GM) model class (for example, Herman, Gazis et al. GM model, Gipps’s model, Payne’s model, Newell’s optimal velocity (OV) model, Wiedemann’s model, Bando et al. OV model, Treiber’s IDM, Krauß’s model), (iii) the understanding of highway capacity as a particular stochastic value, and (iv) principles for traffic and transportation network optimization and control (for example, Wardrop’s user equilibrium (UE) and system optimum (SO) principles). Alternatively to these generally accepted fundamentals and methodologies of traffic and transportation theory, we discuss three-phase traffic theory as the basis for traffic flow modeling as well as briefly consider the network breakdown minimization (BM) principle for the optimization of traffic and transportation networks with road bottlenecks.
Houze, Jr., Robert A.
2013-11-13
We examined cloud radar data in monsoon climates, using cloud radars at Darwin in the Australian monsoon, on a ship in the Bay of Bengal in the South Asian monsoon, and at Niamey in the West African monsoon. We followed on with a more in-depth study of the continental MCSs over West Africa. We investigated whether the West African anvil clouds connected with squall line MCSs passing over the Niamey ARM site could be simulated in a numerical model by comparing the observed anvil clouds to anvil structures generated by the Weather Research and Forecasting (WRF) mesoscale model at high resolution using six different ice-phase microphysical schemes. We carried out further simulations with a cloud-resolving model forced by sounding network budgets over the Niamey region and over the northern Australian region. We have devoted some of the effort of this project to examining how well satellite data can determine the global breadth of the anvil cloud measurements obtained at the ARM ground sites. We next considered whether satellite data could be objectively analyzed to so that their large global measurement sets can be systematically related to the ARM measurements. Further differences were detailed between the land and ocean MCS anvil clouds by examining the interior structure of the anvils with the satellite-detected the CloudSat Cloud Profiling Radar (CPR). The satellite survey of anvil clouds in the Indo-Pacific region was continued to determine the role of MCSs in producing the cloud pattern associated with the MJO.
Chemical-equilibrium calculations for aqueous geothermal brines
Kerrisk, J.F.
1981-05-01
Results from four chemical-equilibrium computer programs, REDEQL.EPAK, GEOCHEM, WATEQF, and SENECA2, have been compared with experimental solubility data for some simple systems of interest with geothermal brines. Seven test cases involving solubilities of CaCO/sub 3/, amorphous SiO/sub 2/, CaSO/sub 4/, and BaSO/sub 4/ at various temperatures from 25 to 300/sup 0/C and in NaCl or HCl solutions of 0 to 4 molal have been examined. Significant differences between calculated results and experimental data occurred in some cases. These differences were traced to inaccuracies in free-energy or equilibrium-constant data and in activity coefficients used by the programs. Although currently available chemical-equilibrium programs can give reasonable results for these calculations, considerable care must be taken in the selection of free-energy data and methods of calculating activity coefficients.
Equilibrium and Stability of High-{beta} Plasmas in Wendelstein 7-AS
Geiger, Joachim E.; Weller, Arthur; Zarnstorff, Michael C.; Nuehrenberg, Carolin; Werner, Andreas Horst Franz; Kolesnichenko, Yaroslav I.
2004-07-15
One of the major goals for Wendelstein 7-AS (W7-AS) was the testing of the theoretical basis for the optimized configuration of Wendelstein 7-X (W7-X), currently under construction in Greifswald, Germany. In the last experimental campaign of W7-AS, volume-averaged {beta} values >3% have been achieved. The underlying experimental changes leading to these results are briefly reviewed. The equilibrium characteristics expected from magnetohydrodynamic (MHD) theory are modeled in a simplified picture and compared with three-dimensional equilibrium calculations. A wide range of parameters has been covered in the experiments with and without net toroidal currents. Experimental data are compared with free-boundary equilibrium calculations and exhibit good agreement. The high-{beta} equilibria usually showed only small MHD activity. The most prominent activities are low-frequency pressure-driven modes connected with low-order rationals also expected from numerical calculations using the CAS3D code, and Alfv and eacute;n modes driven by energetic particles from the tangential neutral beam injection. Comparison of experimentally measured frequencies and mode structures from soft-X-ray tomography with theoretical predictions also shows the improving understanding of these modes in stellarators. The agreement of experiment and theory gives confidence in the predictions for W7-X.
MINEQL-EIR. Chemical Equilibrium Composition of Aqueous Systems
Westall, J.C.; Zachary, J.L.; Morel, F.M.M; Schweingruber, M.
1986-11-21
MINEQL is a subroutine package to calculate equilibrium composition of an aqueous system, accounting for mass transfer. MINEQL-EIR contains an additional base on enthalpy and heat capacity data and has the option to do calculations at temperatures different from 25 degrees C.
Geodesic acoustic modes in tokamak plasmas with a radial equilibrium electric field
Zhou, Deng
2015-09-15
The dispersion relation of geodesic acoustic modes in the tokamak plasma with an equilibrium radial electric field is derived and analyzed. Multiple branches of eigenmodes have been found, similar to the result given by the fluid model with a poloidal mass flow. Frequencies and damping rates of both the geodesic acoustic mode and the sound wave increase with respect to the strength of radial electric field, while the frequency and the damping rate of the lower frequency branch slightly decrease. Possible connection to the experimental observation is discussed.
Isolated many-body quantum systems far from equilibrium: Relaxation process and thermalization
Torres-Herrera, E. J.; Santos, Lea F.
2014-10-15
We present an overview of our recent numerical and analytical results on the dynamics of isolated interacting quantum systems that are taken far from equilibrium by an abrupt perturbation. The studies are carried out on one-dimensional systems of spins-1/2, which are paradigmatic models of many-body quantum systems. Our results show the role of the interplay between the initial state and the post-perturbation Hamiltonian in the relaxation process, the size of the fluctuations after equilibration, and the viability of thermalization.
Equilibrium and Stability of Partial Toroidal Plasma Discharges
Oz, E.; Myers, C. E.; Yamada, M.; Ji, H.; Kulsrud, R.; Xie, J.
2011-01-04
The equilibrium and stability of partial toroidal flux ropes are studied in detail in the laboratory, motivated by ubiquitous loop structures on the solar surface. The flux ropes studied here are magnetized arc discharges formed in the Magnetic Reconnection Experiment (MRX). It is found that these loops robustly maintain their equilibrium on time scales much longer than the Alfven time over a wide range of plasma current, guide eld strength, and angle between electrodes, even in the absence of a strapping fi eld. Additionally, the external kink stability of these flux ropes is found to be governed by the Kruskal-Shafranov limit for a flux rope with line-tied boundary conditions at both ends (q > 1).
Gent, F. A.; Erdélyi, R.; Fedun, V.
2014-07-01
A system of multiple open magnetic flux tubes spanning the solar photosphere and lower corona is modeled analytically, within a realistic stratified atmosphere subject to solar gravity. This extends results for a single magnetic flux tube in magnetohydrostatic equilibrium, described in Gent et al. Self-similar magnetic flux tubes are combined to form magnetic structures, which are consistent with high-resolution observations. The observational evidence supports the existence of strands of open flux tubes and loops persisting in a relatively steady state. Self-similar magnetic flux tubes, for which an analytic solution to the plasma density and pressure distribution is possible, are combined. We calculate the appropriate balancing forces, applying to the equations of momentum and energy conservation to preserve equilibrium. Multiplex flux tube configurations are observed to remain relatively stable for up to a day or more, and it is our aim to apply our model as the background condition for numerical studies of energy transport mechanisms from the solar surface to the corona. We apply magnetic field strength, plasma density, pressure, and temperature distributions consistent with observational and theoretical estimates for the lower solar atmosphere. Although each flux tube is identical in construction apart from the location of the radial axis, combinations can be applied to generate a non-axisymmetric magnetic field with multiple non-uniform flux tubes. This is a considerable step forward in modeling the realistic magnetized three-dimensional equilibria of the solar atmosphere.
Surface Structures Far-from-Equilibrium | The Ames Laboratory
U.S. Department of Energy (DOE) all webpages (Extended Search)
Surface Structures Far-from-Equilibrium Research Personnel Updates Publications Synthesis The emergence of novel properties in nanostructures can be related to various factors, important ones being electron confinement and lower atom coordination. The goals of this FWP are two-fold, first to grow epitaxially controllable nanostructures and second to use their novel, selectable properties on several technologically important problems. Achieving these goals it is also essential to find ways to
Non-Equilibrium Pathways during Electrochemical Phase Transformations in
U.S. Department of Energy (DOE) all webpages (Extended Search)
Single Crystals Revealed by Dynamic Chemical Imaging at Nanoscale Resolution | Stanford Synchrotron Radiation Lightsource Non-Equilibrium Pathways during Electrochemical Phase Transformations in Single Crystals Revealed by Dynamic Chemical Imaging at Nanoscale Resolution Friday, February 27, 2015 The energy density of current batteries is limited by the practical capacity of the positive electrode, which is the determined by the properties of the active material and its concentration in the
Gunardi,; Setiawan, Ezra Putranda
2015-12-22
Indonesia is a country with high risk of earthquake, because of its position in the border of earth’s tectonic plate. An earthquake could raise very high amount of damage, loss, and other economic impacts. So, Indonesia needs a mechanism for transferring the risk of earthquake from the government or the (reinsurance) company, as it could collect enough money for implementing the rehabilitation and reconstruction program. One of the mechanisms is by issuing catastrophe bond, ‘act-of-God bond’, or simply CAT bond. A catastrophe bond issued by a special-purpose-vehicle (SPV) company, and then sold to the investor. The revenue from this transaction is joined with the money (premium) from the sponsor company and then invested in other product. If a catastrophe happened before the time-of-maturity, cash flow from the SPV to the investor will discounted or stopped, and the cash flow is paid to the sponsor company to compensate their loss because of this catastrophe event. When we consider the earthquake only, the amount of discounted cash flow could determine based on the earthquake’s magnitude. A case study with Indonesian earthquake magnitude data show that the probability of maximum magnitude can model by generalized extreme value (GEV) distribution. In pricing this catastrophe bond, we assumed stochastic interest rate that following the Cox-Ingersoll-Ross (CIR) interest rate model. We develop formulas for pricing three types of catastrophe bond, namely zero coupon bonds, ‘coupon only at risk’ bond, and ‘principal and coupon at risk’ bond. Relationship between price of the catastrophe bond and CIR model’s parameter, GEV’s parameter, percentage of coupon, and discounted cash flow rule then explained via Monte Carlo simulation.
NON-EQUILIBRIUM DYNAMICS OF MANY-BODY QUANTUM SYSTEMS: FUNDAMENTALS AND NEW FRONTIER
DeMille, David; LeHur, Karyn
2013-11-27
Rapid progress in nanotechnology and naofabrication techniques has ushered in a new era of quantum transport experiments. This has in turn heightened the interest in theoretical understanding of nonequilibrium dynamics of strongly correlated quantum systems. This project has advanced the frontiers of understanding in this area along several fronts. For example, we showed that under certain conditions, quantum impurities out of equilibrium can be reformulated in terms of an effective equilibrium theory; this makes it possible to use the gamut of tools available for quantum systems in equilibrium. On a different front, we demonstrated that the elastic power of a transmitted microwave photon in circuit QED systems can exhibit a many-body Kondo resonance. We also showed that under many circumstances, bipartite fluctuations of particle number provide an effective tool for studying many-body physics—particularly the entanglement properties of a many-body system. This implies that it should be possible to measure many-body entanglement in relatively simple and tractable quantum systems. In addition, we studied charge relaxation in quantum RC circuits with a large number of conducting channels, and elucidated its relation to Kondo models in various regimes. We also extended our earlier work on the dynamics of driven and dissipative quantum spin-boson impurity systems, deriving a new formalism that makes it possible to compute the full spin density matrix and spin-spin correlation functions beyond the weak coupling limit. Finally, we provided a comprehensive analysis of the nonequilibrium transport near a quantum phase transition in the case of a spinless dissipative resonant-level model. This project supported the research of two Ph.D. students and two postdoctoral researchers, whose training will allow them to further advance the field in coming years.
Calculation of Design Parameters for an Equilibrium LEU Core in the NBSR
Hanson, A.L.; Diamond, D.
2011-09-30
A plan is being developed for the conversion of the NIST research reactor (NBSR) from high-enriched uranium (HEU) fuel to low-enriched uranium (LEU) fuel. Previously, the design of the LEU fuel had been determined in order to provide the users of the NBSR with the same cycle length as exists for the current HEU fueled reactor. The fuel composition at different points within an equilibrium fuel cycle had also been determined. In the present study, neutronics parameters have been calculated for these times in the fuel cycle for both the existing HEU and the proposed LEU equilibrium cores. The results showed differences between the HEU and LEU cores that would not lead to any significant changes in the safety analysis for the converted core. In general the changes were reasonable except that the figure-of-merit for neutrons that can be used by experimentalists shows there will be a 10% reduction in performance. The calculations included kinetics parameters, reactivity coefficients, reactivity worths of control elements and abnormal configurations, and power distributions.
Constrained Generalized Supersymmetries
Toppan, Francesco; Kuznetsova, Zhanna
2005-10-17
We present a classification of admissible types of constraint (hermitian, holomorphic, with reality condition on the bosonic sectors, etc.) for generalized supersymmetries in the presence of complex spinors. A generalized supersymmetry algebra involving n-component real spinors Qa is given by the anticommutators {l_brace}Q{sub a},Q{sub b}{r_brace} = Z{sub ab} where the matrix Z appearing in the r.h.s. is the most general symmetric matrix. A complex generalized supersymmetry algebra is expressed in terms of complex spinors Qa and their complex conjugate Q* a. The most general (with a saturated r.h.s.) algebra is in this case given by {l_brace}Q{sub a},Q{sub b}{r_brace} P{sub ab}{l_brace}Q*{sub a}, Q*{sub b}{r_brace} = P*{sub ab}{l_brace}Q{sub a},Q*{sub b}{r_brace} = R{sub ab} where the matrix Pab is symmetric, while Rab is hermitian. The bosonic right hand side can be expressed in terms of the rank-k totally antisymmetric tensors P{sub ab} {sigma}k(C{gamma}{sub [{mu}}{sub 1...{mu}}{sub k]}){sub ab}P{sup [{mu}{sup 1...{mu}{sup k}]}.The decomposition in terms of anti-symmetric tensors for any space-time up to dimension D = 13 is presented. Real type, complex type, and quaternionic type space-times are classified. Any restriction on the saturated bosonic generators that allows all possible combinations of these tensors is in principle admissible by a Lorenz-covariant requirement. We investigate division algebra constraints and their influence on physical models. High spin theory models are presented as examples of the applications of such models.
Code System to Calculate Nuclear Reaction Cross Sections by Evaporation Model.
Energy Science and Technology Software Center (OSTI)
2000-11-27
Version: 00 Both STAPRE and STAPREF are included in this package. STAPRE calculates energy-averaged cross sections for nuclear reactions with emission of particles and gamma rays and fission. The models employed are the evaporation model with inclusion of pre-equilibrium decay and a gamma-ray cascade model. Angular momentum and parity conservation are accounted for. Major improvement in the 1976 STAPRE program relates to level density approach, implemented in subroutine ZSTDE. Generalized superfluid model is incorporated, boltzman-gasmore » modeling of intrinsic state density and semi-empirical modeling of a few-quasiparticle effects in total level density at equilibrium and saddle deformations of actinide nuclei. In addition to the activation cross sections, particle and gamma-ray production spectra are calculated. Isomeric state populations and production cross sections for gamma rays from low excited levels are obtained, too. For fission a single or a double humped barrier may be chosen.« less
Decoherence of spin-deformed bosonic model
Dehdashti, Sh.; Mahdifar, A.; Bagheri Harouni, M.; Roknizadeh, R.
2013-07-15
The decoherence rate and some parameters affecting it are investigated for the generalized spin-boson model. We consider the spin-bosonic model when the bosonic environment is modeled by the deformed harmonic oscillators. We show that the state of the environment approaches a non-linear coherent state. Then, we obtain the decoherence rate of a two-level system which is in contact with a deformed bosonic environment which is either in thermal equilibrium or in the ground state. By using some recent realization of f-deformed oscillators, we show that some physical parameters strongly affect the decoherence rate of a two-level system. -- Highlights: •Decoherence of the generalized spin-boson model is considered. •In this model the environment consists of f-oscillators. •Via the interaction, the state of the environment approaches non-linear coherent states. •Effective parameters on decoherence are considered.
High-Z Non-Equilibrium Physics and Bright X-ray Sources with...
Office of Scientific and Technical Information (OSTI)
Technical Report: High-Z Non-Equilibrium Physics and Bright X-ray Sources with New Laser Targets Citation Details In-Document Search Title: High-Z Non-Equilibrium Physics and ...
Paschalidis, Vasileios; MacLeod, Morgan; Baumgarte, Thomas W.; Shapiro, Stuart L.
2009-07-15
White dwarf-neutron star binaries generate detectable gravitational radiation. We construct Newtonian equilibrium models of corotational white dwarf-neutron star (WDNS) binaries in circular orbit and find that these models terminate at the Roche limit. At this point the binary will undergo either stable mass transfer (SMT) and evolve on a secular time scale, or unstable mass transfer (UMT), which results in the tidal disruption of the WD. The path a given binary will follow depends primarily on its mass ratio. We analyze the fate of known WDNS binaries and use population synthesis results to estimate the number of LISA-resolved galactic binaries that will undergo either SMT or UMT. We model the quasistationary SMT epoch by solving a set of simple ordinary differential equations and compute the corresponding gravitational waveforms. Finally, we discuss in general terms the possible fate of binaries that undergo UMT and construct approximate Newtonian equilibrium configurations of merged WDNS remnants. We use these configurations to assess plausible outcomes of our future, fully relativistic simulations of these systems. If sufficient WD debris lands on the NS, the remnant may collapse, whereby the gravitational waves from the inspiral, merger, and collapse phases will sweep from LISA through LIGO frequency bands. If the debris forms a disk about the NS, it may fragment and form planets.
Thermal equilibrium of non-neutral plasma in dipole magnetic field
Sato, N.; Kasaoka, N.; Yoshida, Z.
2015-04-15
Self-organization of a long-lived structure is one of the remarkable characteristics of macroscopic systems governed by long-range interactions. In a homogeneous magnetic field, a non-neutral plasma creates a “thermal equilibrium,” which is a Boltzmann distribution on a rigidly rotating frame. Here, we study how a non-neutral plasma self-organizes in inhomogeneous magnetic field; as a typical system, we consider a dipole magnetic field. In this generalized setting, the plasma exhibits its fundamental mechanism that determines the relaxed state. The scale hierarchy of adiabatic invariants is the determinant; the Boltzmann distribution under the topological constraint by the robust adiabatic invariants (hence, the homogeneous distribution with respect to the fragile invariant) is the relevant relaxed state, which turns out to be a rigidly rotating clump of particles (just same as in a homogeneous magnetic field), while the density is no longer homogeneous.
Early Out-Of-Equilibrium Beam-Plasma Evolution
Firpo, M.-C.; Lifschitz, A.F.
2006-03-24
We solve analytically the out-of-equilibrium initial stage that follows the injection of a radially finite electron beam into a plasma at rest and test it against particle-in-cell simulations. For initial large beam edge gradients and not too large beam radius, compared to the electron skin depth, the electron beam is shown to evolve into a ring structure. For low enough transverse temperatures, the filamentation instability eventually proceeds and saturates when transverse isotropy is reached. The analysis accounts for the variety of very recent experimental beam transverse observations.
Axisymmetric plasma equilibrium in gravitational and magnetic fields
Krasheninnikov, S. I.; Catto, P. J.
2015-12-15
Plasma equilibria in gravitational and open-ended magnetic fields are considered for the case of topologically disconnected regions of the magnetic flux surfaces where plasma occupies just one of these regions. Special dependences of the plasma temperature and density on the magnetic flux are used which allow the solution of the Grad–Shafranov equation in a separable form permitting analytic treatment. It is found that plasma pressure tends to play the dominant role in the setting the shape of magnetic field equilibrium, while a strong gravitational force localizes the plasma density to a thin disc centered at the equatorial plane.
Coupled spin-boson systems far from equilibrium
Salkola, M.I. [Department of Physics, Stanford University, Stanford, California 94305 (United States)] [Department of Physics, Stanford University, Stanford, California 94305 (United States); Bishop, A.R. [Theoretical Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States)] [Theoretical Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545 (United States); Kenkre, V.M.; Raghavan, S. [Center for Advanced Studies, University of New Mexico, Albuquerque, New Mexico 87131 (United States)] [Center for Advanced Studies, University of New Mexico, Albuquerque, New Mexico 87131 (United States)
1996-11-01
Nonequilibrium quantum dynamics of a system comprising a (pseudo) spin-1/2 object coupled to a boson degree of freedom is studied. It is shown that the time evolution of the system is described by a set of elementary scattering processes. Through these processes the system approaches an equilibrium in which the spin is in a mixed state that on average maximizes its entropy. However, the irregular behavior of the system is unrelated to {open_quote}{open_quote}quantum chaos{close_quote}{close_quote} as the Hamiltonian is integrable. {copyright} {ital 1996 The American Physical Society.}
Equilibrium magnetohydrodynamic flows of liquid metals in magnetorotational instability experiments
U.S. Department of Energy (DOE) all webpages (Extended Search)
Fluid Mech. (2010), vol. 644, pp. 257-280. c Cambridge University Press 2010 doi:10.1017/S0022112009992394 257 Equilibrium magnetohydrodynamic flows of liquid metals in magnetorotational instability experiments I. V. K H A L Z O V 1 †, A. I. S M O L Y A K O V 2 A N D V. I. I L G I S O N I S 3 1 Center for Magnetic Self-Organization, University of Wisconsin, 1150 University Avenue, Madison, WI 53706, USA 2 University of Saskatchewan, 116 Science Place, Saskatoon, Saskatchewan, S7N5E2, Canada 3
Stoliker, Deborah L.; Liu, Chongxuan; Kent, Douglas B.; Zachara, John M.
2013-02-12
Rates of contaminant U(VI) release from individual size fractions of a composite sediment from the seasonally saturated lower vadose zone of the Hanford 300-Area were examined in flow-through batch reactors to maintain quasi-constant chemical conditions. Variability in equilibrium adsorption among the various size fractions was determined in static batch reactors and analyzed using the surface complexation modeling approach. The estimated stoichiometric coefficients of U(VI) surface complexation reactions with respect to pH and carbonate concentrations varied with size fractions. This source of variability significantly increased the uncertainty in U(VI) conditional equilibrium constants over that estimated from experimental errors alone. A minimum difference between conditional equilibrium constants was established in order to evaluate statistically significant differences between sediment adsorption properties. A set of equilibrium and kinetic expressions for cation exchange, calcite dissolution, aerobic respiration, and silica dissolution were incorporated in a reaction-rate model to describe the temporal evolution of solute concentrations observed during the flow-through batch experiments. Parameters in the reaction-rate model, calibrated using experimental data for select size fractions, predicted the changes in solute concentrations for the bulk, <2 mm, sediment sample. Kinetic U(VI) desorption was well described using a multi-rate surface complexation model with an assumed lognormal distribution for the rate constants. The estimated mean and standard deviation were the same for all < 2mm size fractions, but differed in the 2-8mm size fraction. Micropore volumes in the varied size fractions were also similar as assessed using t-plots to analyze N2 desorption data. These findings provide further support for the link between microporosity and particle-scale mass transfer rates controlling kinetic U(VI) adsorption/desorption and for the utility of N2 desorption
Rotational and translational temperature equilibrium in an inductively coupled plasma
Shimada, Masashi; Tynan, George R.; Cattolica, Robert
2006-09-15
Rotational temperature has been used widely as neutral gas temperature measurement in different types of plasmas (electron cyclotron resonance, inductively coupled plasma, helicon, hollow cathode, etc.), and has been assumed to be in equilibrium with translational temperature. The direct experimental comparison of rotational and translational temperature in low-temperature plasmas has not been reported. In this research, optical emission spectroscopy is used to measure the neutral gas rotational temperature, T{sub rot}, from the second-positive band of a nitrogen molecule (380 nm). The results are compared with the Doppler-broadened translational temperature, T{sub trans}, of Ar (750 nm) and He (587 nm), determined with a high-resolution spectrometer at various partial pressures of N{sub 2} in Ar/N{sub 2} and He/N{sub 2} plasmas. The results demonstrated that T{sub rot} and T{sub trans} are in equilibrium in the conditions [10{sup 10}
Ideal magnetohydrodynamic equilibrium in a non-symmetric topological torus
Weitzner, Harold
2014-02-15
An alternative representation of an ideal magnetohydrodynamic equilibrium is developed. The representation is a variation of one given by A. Salat, Phys. Plasmas 2, 1652 (1995). The system of equations is used to study the possibility of non-symmetric equilibria in a topological torus, here an approximate rectangular parallelopiped, with periodicity in two of the three rectangular coordinates. An expansion is carried out in the deviation of pressure surfaces from planes. Resonances are manifest in the process. Nonetheless, provided the magnetic shear is small, it is shown that it is possible to select the magnetic fields and flux surfaces in such a manner that no singularities appear on resonant surfaces. One boundary surface of the parallelopiped is not arbitrary but is dependent on the equilibrium in question. A comparison of the solution sets of axisymmetric and non-axisymmetric equilibria suggests that the latter have a wider class of possible boundary shapes but more restrictive rotational transform profiles. No proof of convergence of the series is given.
Off-equilibrium photon production during the chiral phase transition
Michler, Frank; Hees, Hendrik van; Dietrich, Dennis D.; Leupold, Stefan; Greiner, Carsten
2013-09-15
In the early stage of ultrarelativistic heavy-ion collisions chiral symmetry is restored temporarily. During this so-called chiral phase transition, the quark masses change from their constituent to their bare values. This mass shift leads to the spontaneous non-perturbative creation of quarkantiquark pairs, which effectively contributes to the formation of the quarkgluon plasma. We investigate the photon production induced by this creation process. We provide an approach that eliminates possible unphysical contributions from the vacuum polarization and renders the resulting photon spectra integrable in the ultraviolet domain. The off-equilibrium photon numbers are of quadratic order in the perturbative coupling constants while a thermal production is only of quartic order. Quantitatively, we find, however, that for the most physical mass-shift scenarios and for photon momenta larger than 1 GeV the off-equilibrium processes contribute less photons than the thermal processes. -- Highlights: We investigate first-order photon emission arising from the chiral mass shift. We provide an ansatz eliminating possible unphysical vacuum contributions. Our ansatz leads to photon spectra being integrable in the ultraviolet domain.
U.S. Department of Energy (DOE) all webpages (Extended Search)
C General Tables The General Table for 8C is subdivided into the following categories: Reviews Other Theoretical Work
Measurement and modeling of advanced coal conversion processes, Volume III
Ghani, M.U.; Hobbs, M.L.; Hamblen, D.G.
1993-08-01
A generalized one-dimensional, heterogeneous, steady-state, fixed-bed model for coal gasification and combustion is presented. The model, FBED-1, is a design and analysis tool that can be used to simulate a variety of gasification, devolatilization, and combustion processes. The model considers separate gas and solid temperatures, axially variable solid and gas flow rates, variable bed void fraction, coal drying, devolatilization based on chemical functional group composition, depolymerization, vaporization and crosslinking, oxidation, and gasification of char, and partial equilibrium in the gas phase.
Collins, David
2010-05-15
A general framework for regarding oracle-assisted quantum algorithms as tools for discriminating among unitary transformations is described. This framework is applied to the Deutsch-Jozsa problem and all possible quantum algorithms which solve the problem with certainty using oracle unitaries in a particular form are derived. It is also used to show that any quantum algorithm that solves the Deutsch-Jozsa problem starting with a quantum system in a particular class of initial, thermal equilibrium-based states of the type encountered in solution-state NMR can only succeed with greater probability than a classical algorithm when the problem size n exceeds {approx}10{sup 5}.
Off-equilibrium sphaleron transitions in the Glasma
Mace, Mark; Schlichting, Soren; Venugopalan, Raju
2016-04-28
We perform the first, to our knowledge, classical-statistical real time lattice simulations of topological transitions in the nonequilibrium glasma of weakly coupled but highly occupied gauge fields created immediately after the collision of ultrarelativistic nuclei. Simplifying our description by employing SU(2) gauge fields, and neglecting their longitudinal expansion, we find that the rate of topological transitions is initially strongly enhanced relative to the thermal sphaleron transition rate and decays with time during the thermalization process. Qualitative features of the time dependence of this nonequilibrium transition rate can be understood when expressed in terms of the magnetic screening length, which wemore » also extract nonperturbatively. Furthermore, a detailed investigation of auto-correlation functions of the Chern-Simons number (NCS) reveals non-Markovian features of the evolution distinct from previous simulations of non-Abelian plasmas in thermal equilibrium.« less
Bozeman, Jeffrey; Chen, Kuo-Huey
2014-12-09
On November 3, 2009, General Motors (GM) accepted U.S. Department of Energy (DOE) Cooperative Agreement award number DE-EE0000014 from the National Energy Technology Laboratory (NETL). GM was selected to execute a three-year cost shared research and development project on Solid State Energy Conversion for Vehicular Heating, Ventilation & Air Conditioning (HVAC) and for Waste Heat Recovery.
Aqueous Electrolyte Modeling in Aspen Plus G. E
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... The Dielectric Constant of Water and Debye-Huckel limiting Law Slopes, J. Phys. Chem. Ref. ... Dissolved gases are modeled using Henry's Law. Chemical reaction equilibrium is modeled ...
Study on Equilibrium Characteristics of Thorium-Plutonium-Minor Actinides Mixed Oxides Fuel in PWR
Waris, A.; Permana, S.; Kurniadi, R.; Su'ud, Z.; Sekimoto, H.
2010-06-22
A study on characteristics of thorium-plutonium-minor actinides utilization in the pressurized water reactor (PWR) with the equilibrium burnup model has been conducted. For a comprehensive evaluation, several fuel cycles scenario have been included in the present study with the variation of moderator-to-fuel volume ratio (MFR) of PWR core design. The results obviously exhibit that the neutron spectra grow to be harder with decreasing of the MFR. Moreover, the neutron spectra also turn into harder with the rising number of confined heavy nuclides. The required {sup 233}U concentration for criticality of reactor augments with the increasing of MFR for all heavy nuclides confinement and thorium and uranium confinement in PWR.
Numerical solution of 2D wet steam flow with non-equilibrium condensation and real thermodynamics
Hric, V.; Halama, J.
2015-03-10
An approach to modeling of wet steam flow with non-equilibrium condensation phenomenon is presented. The first part of our flow model is homogeneous Euler system of transport equations for mass, momentum and total energy of wet steam (mixture). The additional second part describes liquid phase via non-homogeneous system of transport equations for moments of droplets number distribution function and relies on corrected classical nucleation theory. Moment equations are closed by linearization of droplet growth rate model. All necessary relations for thermodynamic properties of steam are provided by IAPWS set of equations. However, properties of condensate are simply modeled by liquid saturation data. Two real equations of state are implemented. Recently developed CFD formulation for entropy (does not require iteration process) and so-called IAPWS special gas equation for Helmholtz energy (one iteration loop is necessary). Flow model is validated on converging-diverging supersonic nozzle with Barschdorff geometry. Simulations were performed by in-house CFD code based on finite volume method and stiff character of equations was solved by symmetrical time operator splitting. Achieved results satisfactorily agreed with experimental data.
V. Ramaswamy; L. J. Donner; J-C. Golaz; S. A. Klein
2010-06-17
This report briefly summarizes the progress made by ARM postdoctoral fellow, Yanluan Lin, at GFDL during the period from October 2008 to present. Several ARM datasets have been used for GFDL model evaluation, understanding, and improvement. This includes a new ice fall speed parameterization with riming impact and its test in GFDL AM3, evaluation of model cloud and radiation diurnal and seasonal variation using ARM CMBE data, model ice water content evaluation using ARM cirrus data, and coordination of the TWPICE global model intercomparison. The work illustrates the potential and importance of ARM data for GCM evaluation, understanding, and ultimately, improvement of GCM cloud and radiation parameterizations. Future work includes evaluation and improvement of the new dynamicsPDF cloud scheme and aerosol activation in the GFDL model.
Modeling for Anaerobic Fixed-Bed Biofilm Reactors
Liu, B. Y. M.; Pfeffer, J. T.
1989-06-01
The specific objectives of this research were: 1. to develop an equilibrium model for chemical aspects of anaerobic reactors; 2. to modify the equilibrium model for non-equilibrium conditions; 3. to incorporate the existing biofilm models into the models above to study the biological and chemical behavior of the fixed-film anaerobic reactors; 4. to experimentally verify the validity of these models; 5. to investigate the biomass-holding ability of difference packing materials for establishing reactor design criteria.
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Todd T. Nichols; Dean D. Taylor
2003-09-01
A status is presented of the parameterization during FY2003 of an association-based Pitzer model to simulate chemical and phase equilibria of acid-chloride-nitrate-mercury aqueous electrolyte systems at 0-100° C within the industry-standard process simulator, ASPEN Plus. Compatibility with ASPEN Plus requires that the Pitzer model used be limited to the third virial coefficient and have the values of b and a1 as originally proposed by Pitzer. Two aqueous models for 0-110° C at atmospheric pressure were parameterized in FY03. The model for the aqueous H+-K+-Na+-Cl- system is applicable for 0-16 molal, and the HNO3-H2O for 0-20 molal. An association-based Pitzer activity coefficient model is combined with Henry.s law to predict activity/osmotic coefficient and VLE. The chloride model also predicts KCl and NaCl solubility, while the nitric acid model has the unique capability of predicting extent of dissociation with an average absolute deviation of 1.43%. The association-based approach presented here extends the utility of the molality-based Pitzer model past 6 molal to predict activity/osmotic coefficients up to 16-20 molal. The association-based approach offers the additional benefits of predicting extent of dissociation and of allowing the Pitzer model to be fully utilized in commercial simulators, such as ASPEN Plus, that require accounting for association to implement Henry’s law. The Pitzer models presented here provide the chemical process simulation engineer with a superior alternative to the Electrolyte NRTL model that can easily be used in ASPEN Plus.
Nichols,T.T.; Taylor,D.D.
2003-09-26
A status is presented of the parameterization during FY2003 of an association-based Pitzer model to simulate chemical and phase equilibria of acid-chloride-nitrate-mercury aqueous electrolyte systems at 0-100 C within the industry-standard process simulator, ASPEN Plus. Compatibility with ASPEN Plus requires that the Pitzer model used be limited to the third virial coefficient and have the values of b and a1 as originally proposed by Pitzer. Two aqueous models for 0-110 C at atmospheric pressure were parameterized in FY03. The model for the aqueous H+-K+-Na+-Cl- system is applicable for 0-16 molal, and the HNO3-H2O for 0-20 molal. An association-based Pitzer activity coefficient model is combined with Henry's law to predict activity/osmotic coefficient and VLE. The chloride model also predicts KCl and NaCl solubility, while the nitric acid model has the unique capability of predicting extent of dissociation with an average absolute deviation of 1.43%. The association-based approach presented here extends the utility of the molality-based Pitzer model past 6 molal to predict activity/osmotic coefficients up to 16-20 molal. The association-based approach offers the additional benefits of predicting extent of dissociation and of allowing the Pitzer model to be fully utilized in commercial simulators, such as ASPEN Plus, that require accounting for association to implement Henry's law. The Pitzer models presented here provide the chemical process simulation engineer with a superior alternative to the Electrolyte NRTL model that can easily be used in ASPEN Plus.
Sathaye, Jayant; Makundi, Willy; Dale, Larry; Chan, Peter; Andrasko, Kenneth
2005-03-22
This paper reports on the global potential for carbonsequestration in forest plantations, and the reduction of carbonemissions from deforestation, in response to six carbon price scenariosfrom 2000 to 2100. These carbon price scenarios cover a range typicallyseen in global integrated assessment models. The world forest sector wasdisaggregated into tenregions, four largely temperate, developedregions: the European Union, Oceania, Russia, and the United States; andsix developing, mostly tropical, regions: Africa, Central America, China,India, Rest of Asia, and South America. Three mitigation options -- long-and short-rotation forestry, and the reduction of deforestation -- wereanalyzed using a global dynamic partial equilibrium model (GCOMAP). Keyfindings of this work are that cumulative carbon gain ranges from 50.9 to113.2 Gt C by 2100, higher carbon prices early lead to earlier carbongain and vice versa, and avoided deforestation accounts for 51 to 78percent of modeled carbon gains by 2100. The estimated present value ofcumulative welfare change in the sector ranges from a decline of $158billion to a gain of $81 billion by 2100. The decline is associated witha decrease in deforestation.
Khodadi, M. Sepangi, H.R.
2014-07-15
We study the phase transition from quarkgluon plasma to hadrons in the early universe in the context of non-equilibrium thermodynamics. According to the standard model of cosmology, a phase transition associated with chiral symmetry breaking after the electro-weak transition has occurred when the universe was about 110?s old. We focus attention on such a phase transition in the presence of a viscous relativistic cosmological background fluid in the framework of non-detailed balance Ho?avaLifshitz cosmology within an effective model of QCD. We consider a flat FriedmannRobertsonWalker universe filled with a non-causal and a causal bulk viscous cosmological fluid respectively and investigate the effects of the running coupling constants of Ho?avaLifshitz gravity, ?, on the evolution of the physical quantities relevant to a description of the early universe, namely, the temperature T, scale factor a, deceleration parameter q and dimensionless ratio of the bulk viscosity coefficient to entropy density (?)/s . We assume that the bulk viscosity cosmological background fluid obeys the evolution equation of the steady truncated (Eckart) and full version of the IsraelStewart fluid, respectively. -- Highlights: In this paper we have studied quarkhadron phase transition in the early universe in the context of the Ho?avaLifshitz model. We use a flat FRW universe with the bulk viscosity cosmological background fluid obeying the evolution equation of the steady truncated (Eckart) and full version of the IsraelStewart fluid, respectively.
Generalized Cartan Calculus in general dimension
Wang, Yi -Nan
2015-07-22
We develop the generalized Cartan Calculus for the groups G = SL(2,R) × R+, SL(5,R) and SO(5,5). They are the underlying algebraic structures of d=9,7,6 exceptional field theory, respectively. These algebraic identities are needed for the "tensor hierarchy" structure in exceptional field theory. The validity of Poincar\\'e lemmas in this new differential geometry is also discussed. Lastly, we explore some possible extension of the generalized Cartan calculus beyond the exceptional series.
Entanglement Entropy of the Early Universe in Generalized Chaplygin...
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General Merchandise 50% Energy Savings Technical Support Document...
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Publication Year 2009 URL http:www.nrel.govdocsfy09osti46100.pdf Building Models General Merchandise 2009 TSD Chicago High Plug Load Baseline, General Merchandise 2009...
Economic model for seaborne oil trade. Master`s thesis
Kian-Wah, H.
1996-03-01
This thesis aims to provide some insights as to how oil prices and oil flows might vary with the carrying capacity of the tanker fleet as affected by political events. It provides an econometric analysis of tanker freight rates in the modern era and proposes a mathematical (quadratic) programming economic model that links the crude oil market to the supply elasticity of the world oil tanker fleet based on a competitive economy. The economic model can be considered as a version of the Walras-Cassel general-equilibrium system which possesses an economically meaningful equilibrium solution in terms of oil prices, freight rates and the pattern of oil distribution. The implementation of the model is completed using the General Algebraic Modeling System (GAMS). The study concludes with a scenario study showing how the model could be used to examine the importance of South East Asia`s sealanes in world seaborne oil trade. The model shows the economic vulnerability of oil importing nations, especially Japan, the United States, and Western Europe, to a possible closure of South East Asian sealanes.
U.S. Department of Energy (DOE) all webpages (Extended Search)
Table for 5Li is subdivided into the folowing categories: Ground State Properties Cluster Model Shell Model Special States Model Calculations Model Discussions Complex...
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following categories: Ground State Properties Theoretical Special States Shell Model Cluster and alpha-particle Models Other Models Model Calculations Complex Reactions Involving...
Transition from thermal to turbulent equilibrium with a resulting electromagnetic spectrum
Ziebell, L. F.; Yoon, P. H.; School of Space Research, Kyung Hee University, Yongin, Gyeonggi 446-701 ; Gaelzer, R.; Instituto de Física e Matemática, UFPel, Pelotas, RS ; Pavan, J.
2014-01-15
A recent paper [Ziebell et al., Phys. Plasmas 21, 010701 (2014)] discusses a new type of radiation emission process for plasmas in a state of quasi-equilibrium between the particles and enhanced Langmuir turbulence. Such a system may be an example of the so-called “turbulent quasi-equilibrium.” In the present paper, it is shown on the basis of electromagnetic weak turbulence theory that an initial thermal equilibrium state (i.e., only electrostatic fluctuations and Maxwellian particle distributions) transitions toward the turbulent quasi-equilibrium state with enhanced electromagnetic radiation spectrum, thus demonstrating that the turbulent quasi-equilibrium discussed in the above paper correctly describes the weakly turbulent plasma dynamically interacting with electromagnetic fluctuations, while maintaining a dynamical steady-state in the average sense.
Vigil,Benny Manuel; Ballance, Robert; Haskell, Karen
2012-08-09
Cielo is a massively parallel supercomputer funded by the DOE/NNSA Advanced Simulation and Computing (ASC) program, and operated by the Alliance for Computing at Extreme Scale (ACES), a partnership between Los Alamos National Laboratory (LANL) and Sandia National Laboratories (SNL). The primary Cielo compute platform is physically located at Los Alamos National Laboratory. This Cielo Computational Environment Usage Model documents the capabilities and the environment to be provided for the Q1 FY12 Level 2 Cielo Capability Computing (CCC) Platform Production Readiness Milestone. This document describes specific capabilities, tools, and procedures to support both local and remote users. The model is focused on the needs of the ASC user working in the secure computing environments at Lawrence Livermore National Laboratory (LLNL), Los Alamos National Laboratory, or Sandia National Laboratories, but also addresses the needs of users working in the unclassified environment. The Cielo Computational Environment Usage Model maps the provided capabilities to the tri-Lab ASC Computing Environment (ACE) Version 8.0 requirements. The ACE requirements reflect the high performance computing requirements for the Production Readiness Milestone user environment capabilities of the ASC community. A description of ACE requirements met, and those requirements that are not met, are included in each section of this document. The Cielo Computing Environment, along with the ACE mappings, has been issued and reviewed throughout the tri-Lab community.
Coalescence and Chemical Equilibrium in Multifragmentation at Intermediate Energies, T
U.S. Department of Energy (DOE) all webpages (Extended Search)
Coal to Liquids Coal to Liquids Major General Allen Tackett of the National Guard's 130th Airlift Wing dispenses the first fill-up of hydrogen fuel from the Yeager facility. Located in Charleston, WV, the Yeager facility was constructed and operated with support from the Office of Fossil Energyâs National Energy Technology Laboratory. Major General Allen Tackett of the National Guard's 130th Airlift Wing dispenses the first fill-up of hydrogen fuel from the Yeager facility. Located in
Paz-Soldan, C.; Logan, N. C.; Haskey, S. R.; Nazikian, R.; Strait, E. J.; Chen, X.; Ferraro, N. M.; King, J. D.; Lyons, B. C.; Park, J. -K.
2016-03-31
The nature of the multi-modal n=2 plasma response and its impact on global confinement is studied as a function of the axisymmetric equilibrium pressure, edge safety factor, collisionality, and L-versus H-mode conditions. Varying the relative phase (ΔΦUL) between upper and lower in-vessel coils demonstrates that different n=2 poloidal spectra preferentially excite different plasma responses. These different plasma response modes are preferentially detected on the tokamak high-field side (HFS) or low-field side (LFS) midplanes, have different radial extents, couple differently to the resonant surfaces, and have variable impacts on edge stability and global confinement. In all equilibrium conditions studied, the observedmore » confinement degradation shares the same ΔΦUL dependence as the coupling to the resonant surfaces given by both ideal (IPEC) and resistive (MARS-F) MHD computation. Varying the edge safety factor shifts the equilibrium field-line pitch and thus the ΔΦUL dependence of both the global confinement and the n=2 magnetic response. As edge safety factor is varied, modeling finds that the HFS response (but not the LFS response), the resonant surface coupling, and the edge displacements near the X-point all share the same ΔΦUL dependence. The LFS response magnitude is strongly sensitive to the core pressure and is insensitive to the collisionality and edge safety factor. This indicates that the LFS measurements are primarily sensitive to a pressure-driven kink-ballooning mode that couples to the core plasma. MHD modeling accurately reproduces these (and indeed all) LFS experimental trends and supports this interpretation. In contrast to the LFS, the HFS magnetic response and correlated global confinement impact is unchanged with plasma pressure, but is strongly reduced in high collisionality conditions in both H- and L-mode. This experimentally suggests the bootstrap current drives the HFS response through the kink-peeling mode drive, though
Easter, R.C.; Hales, J.M.
1984-11-01
This report is a second-edition user's manual for the PLUVIUS reactive-storm model. The PLUVIUS code simulates the formation of storm systems of a variety of types, and characterizes the behavior of air pollutants as they flow through, react within, and are scavenged by the storms. The computer code supplied with this report is known as PLUVIUS MOD 5.0, and is a substantial improvement over the MOD 3.1 version given in the original user's manual. Example applications of MOD 5.0 are given in the report to facilitate rapid application of the code for a variety of specific uses. 22 references, 7 figures, 48 tables.
Self-consistent chemical model of partially ionized plasmas
Arkhipov, Yu. V.; Baimbetov, F. B.; Davletov, A. E.
2011-01-15
A simple renormalization theory of plasma particle interactions is proposed. It primarily stems from generic properties of equilibrium distribution functions and allows one to obtain the so-called generalized Poisson-Boltzmann equation for an effective interaction potential of two chosen particles in the presence of a third one. The same equation is then strictly derived from the Bogolyubov-Born-Green-Kirkwood-Yvon (BBGKY) hierarchy for equilibrium distribution functions in the pair correlation approximation. This enables one to construct a self-consistent chemical model of partially ionized plasmas, correctly accounting for the close interrelation of charged and neutral components thereof. Minimization of the system free energy provides ionization equilibrium and, thus, permits one to study the plasma composition in a wide range of its parameters. Unlike standard chemical models, the proposed one allows one to study the system correlation functions and thereby to obtain an equation of state which agrees well with exact results of quantum-mechanical activity expansions. It is shown that the plasma and neutral components are strongly interrelated, which results in the short-range order formation in the corresponding subsystem. The mathematical form of the results obtained enables one to both firmly establish this fact and to determine a characteristic length of the structure formation. Since the cornerstone of the proposed self-consistent chemical model of partially ionized plasmas is an effective pairwise interaction potential, it immediately provides quite an efficient calculation scheme not only for thermodynamical functions but for transport coefficients as well.
Karami, K.
2010-01-01
Author of ref. 1, M.R. Setare (JCAP 01 (2007) 023), by redefining the event horizon measured from the sphere of the horizon as the system's IR cut-off for an interacting holographic dark energy model in a non-flat universe, showed that the generalized second law of thermodynamics is satisfied for the special range of the deceleration parameter. His paper includes an erroneous calculation of the entropy of the cold dark matter. Also there are some missing terms and some misprints in the equations of his paper. Here we present that his conclusion is not true and the generalized second law is violated for the present time independently of the deceleration parameter.
A general maximum entropy framework for thermodynamic variational principles
Dewar, Roderick C.
2014-12-05
Minimum free energy principles are familiar in equilibrium thermodynamics, as expressions of the second law. They also appear in statistical mechanics as variational approximation schemes, such as the mean-field and steepest-descent approximations. These well-known minimum free energy principles are here unified and extended to any system analyzable by MaxEnt, including non-equilibrium systems. The MaxEnt Lagrangian associated with a generic MaxEnt distribution p defines a generalized potential Ψ for an arbitrary probability distribution p-hat, such that Ψ is a minimum at (p-hat) = p. Minimization of Ψ with respect to p-hat thus constitutes a generic variational principle, and is equivalent to minimizing the Kullback-Leibler divergence between p-hat and p. Illustrative examples of min–Ψ are given for equilibrium and non-equilibrium systems. An interpretation of changes in Ψ is given in terms of the second law, although min–Ψ itself is an intrinsic variational property of MaxEnt that is distinct from the second law.
Equilibrium, kinetic and thermodynamic studies on the adsorption of phenol onto graphene
Li, Yanhui; Du, Qiuju; Liu, Tonghao; Sun, Jiankun; Jiao, Yuqin; Xia, Yanzhi; Xia, Linhua; Wang, Zonghua; Zhang, Wei; Wang, Kunlin; Zhu, Hongwei; Wu, Dehai
2012-08-15
Graphical abstract: The effect of temperature on phenol adsorbed by graphene shows that the equilibrium adsorption capacity of phenol increases with the increase in temperature from 285 to 333 K. Increasing adsorption capacities with temperature indicates that the adsorption of phenol is controlled by an endothermic reaction. Highlights: ► The graphene has high phenol adsorption capacity. ► The graphene has a high specific surface area of 305 m{sup 2}/g. ► The adsorption capacity is high at acidic pH range. ► The graphene has rapid phenol adsorption rate. ► Phenol adsorption is a spontaneous and endothermic process. -- Abstract: Graphene, a new member of carbon family, has been prepared, characterized and used as adsorbent to remove phenol from aqueous solution. The effect parameters including pH, dosage, contact time, and temperature on the adsorption properties of phenol onto graphene were investigated. The results showed that the maximum adsorption capacity can reach 28.26 mg/g at the conditions of initial phenol concentration of 50 mg/L, pH 6.3 and 285 K. Adsorption data were well described by both Freundlich and Langmuir models. The kinetic study illustrated that the adsorption of phenol onto graphene fit the pseudo second-order model. The thermodynamic parameters indicated that the adsorption of phenol onto graphene was endothermic and spontaneous.
Moffat, Harry K.; Jove-Colon, Carlos F.
2009-06-01
In this report, we summarize our work on developing a production level capability for modeling brine thermodynamic properties using the open-source code Cantera. This implementation into Cantera allows for the application of chemical thermodynamics to describe the interactions between a solid and an electrolyte solution at chemical equilibrium. The formulations to evaluate the thermodynamic properties of electrolytes are based on Pitzer's model to calculate molality-based activity coefficients using a real equation-of-state (EoS) for water. In addition, the thermodynamic properties of solutes at elevated temperature and pressures are computed using the revised Helgeson-Kirkham-Flowers (HKF) EoS for ionic and neutral aqueous species. The thermodynamic data parameters for the Pitzer formulation and HKF EoS are from the thermodynamic database compilation developed for the Yucca Mountain Project (YMP) used with the computer code EQ3/6. We describe the adopted equations and their implementation within Cantera and also provide several validated examples relevant to the calculations of extensive properties of electrolyte solutions.
Office of Energy Efficiency and Renewable Energy (EERE) (indexed site)
APP-005 Planning for and Measuring Office of Inspector General Results FY 2002 Annual Performance Report and FY 2003 Annual Performance Plan Office of Inspector General U.S. Department of Energy Inspector General's Message We are pleased to present the Office of Inspector General's (OIG) consolidated Fiscal Year 2002 Annual Performance Report and Fiscal Year 2003 Annual Performance Plan. This document evaluates our actual Fiscal Year (FY) 2002 performance and establishes the performance goals
Robinson, Troy A
2011-08-01
This dissertation explores lanthanide speciation in liquid solution systems related to separation schemes involving the acidic ligands: bis(2-ethylhexyl) phosphoric acid (HDEHP), lactate, and 8-hydroxyquinoline. Equilibrium speciation of neodymium (Nd^{3+}), sodium (Na+), HDEHP, water, and lactate in the TALSPEAK liquid-liquid extraction system was explored under varied Nd^{3+} loading of HDEHP in the organic phase and through extraction from aqueous HCl and lactate media. System speciation was probed through vapor pressure osmometry, visible and Fourier Transform Infrared (FTIR) spectroscopy, ^{22}Na and ^{13}C labeled lactate radiotracer distribution measurements, Karl Fischer titrations, and equilibrium pH measurements. Distribution of Nd^{3+}, Na^{+}, lactate, and equilibrium pH were modeled using the SXLSQI software to obtain logKNd and logKNa extraction constants under selected conditions. Results showed that high Nd^{3+} loading of the HDEHP led to Nd^{3+} speciation that departs from the ion exchange mechanism and includes formation of highly aggregated, polynuclear [NdLactate(DEHP)_{2}]_{x}; (with x > 1). By substituting lanthanum (La^{3+}) for Nd^{3+} in this system, NMR scoping experiments using ^{23}Na, ^{31}P nuclei and ^{13}C labeled lactate were performed. Results indicated that this technique is sensitive to changes in system speciation, and that further experiments are warranted. In a homogeneous system representing the TALSPEAK aqueous phase, Lactate protonation behavior at various temperatures was characterized using a combination of potentiometric titration and modeling with the Hyperquad computer program. The temperature dependent deprotonation behavior of lactate showed little change with temperature at 2.0 M NaCl ionic strength. Cloud point extraction is a non-traditional separation technique that starts with a homogeneous
Generalized Cartan Calculus in general dimension
Wang, Yi -Nan
2015-07-22
We develop the generalized Cartan Calculus for the groups G = SL(2,R) × R^{+}, SL(5,R) and SO(5,5). They are the underlying algebraic structures of d=9,7,6 exceptional field theory, respectively. These algebraic identities are needed for the "tensor hierarchy" structure in exceptional field theory. The validity of Poincar\\'e lemmas in this new differential geometry is also discussed. Lastly, we explore some possible extension of the generalized Cartan calculus beyond the exceptional series.
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Imaging the equilibrium state and magnetization dynamics of partially built hard disk write heads
Valkass, R. A. J. Yu, W.; Shelford, L. R.; Keatley, P. S.; Loughran, T. H. J.; Hicken, R. J.; Cavill, S. A.; Laan, G. van der; Dhesi, S. S.; Bashir, M. A.; Gubbins, M. A.; Czoschke, P. J.; Lopusnik, R.
2015-06-08
Four different designs of partially built hard disk write heads with a yoke comprising four repeats of NiFe (1 nm)/CoFe (50 nm) were studied by both x-ray photoemission electron microscopy (XPEEM) and time-resolved scanning Kerr microscopy (TRSKM). These techniques were used to investigate the static equilibrium domain configuration and the magnetodynamic response across the entire structure, respectively. Simulations and previous TRSKM studies have made proposals for the equilibrium domain configuration of similar structures, but no direct observation of the equilibrium state of the writers has yet been made. In this study, static XPEEM images of the equilibrium state of writer structures were acquired using x-ray magnetic circular dichroism as the contrast mechanism. These images suggest that the crystalline anisotropy dominates the equilibrium state domain configuration, but competition with shape anisotropy ultimately determines the stability of the equilibrium state. Dynamic TRSKM images were acquired from nominally identical devices. These images suggest that a longer confluence region may hinder flux conduction from the yoke into the pole tip: the shorter confluence region exhibits clear flux beaming along the symmetry axis, whereas the longer confluence region causes flux to conduct along one edge of the writer. The observed variations in dynamic response agree well with the differences in the equilibrium magnetization configuration visible in the XPEEM images, confirming that minor variations in the geometric design of the writer structure can have significant effects on the process of flux beaming.
Extension of the quantum-kinetic model to lunar and Mars return physics
Liechty, D. S.; Lewis, M. J.
2014-02-15
The ability to compute rarefied, ionized hypersonic flows is becoming more important as missions such as Earth reentry, landing high-mass payloads on Mars, and the exploration of the outer planets and their satellites are being considered. A recently introduced molecular-level chemistry model, the quantum-kinetic, or Q-K, model that predicts reaction rates for gases in thermal equilibrium and non-equilibrium using only kinetic theory and fundamental molecular properties, is extended in the current work to include electronic energy level transitions and reactions involving charged particles. Like the Q-K procedures for neutral species chemical reactions, these new models are phenomenological procedures that aim to reproduce the reaction/transition rates but do not necessarily capture the exact physics. These engineering models are necessarily efficient due to the requirement to compute billions of simulated collisions in direct simulation Monte Carlo (DSMC) simulations. The new models are shown to generally agree within the spread of reported transition and reaction rates from the literature for near equilibrium conditions.
Aggregation kinetics in a model colloidal suspension (Journal...
Office of Scientific and Technical Information (OSTI)
For the present model and probably other, more common colloids, the observed clusters appear to be equilibrium phase fluctuations induced by the entropic inter-colloidal ...
The generalized SchrdingerLangevin equation
Bargueo, Pedro; Miret-Arts, Salvador
2014-07-15
In this work, for a Brownian particle interacting with a heat bath, we derive a generalization of the so-called SchrdingerLangevin or Kostin equation. This generalization is based on a nonlinear interaction model providing a state-dependent dissipation process exhibiting multiplicative noise. Two straightforward applications to the measurement process are then analyzed, continuous and weak measurements in terms of the quantum Bohmian trajectory formalism. Finally, it is also shown that the generalized uncertainty principle, which appears in some approaches to quantum gravity, can be expressed in terms of this generalized equation. -- Highlights: We generalize the Kostin equation for arbitrary systembath coupling. This generalization is developed both in the Schrdinger and Bohmian formalisms. We write the generalized Kostin equation for two measurement problems. We reformulate the generalized uncertainty principle in terms of this equation.
2012-04-01
Solid-state lighting program technology fact sheet that compares general service incandescent lamps—i.e., light bulbs—to LED and CFL alternatives.
A U.S. DOE SSL technology fact sheet that compares general service LED light bulbs with incandescent and CFL bulbs.
High-Z Non-Equilibrium Physics and Bright X-ray Sources with...
Office of Scientific and Technical Information (OSTI)
X-ray Sources with New Laser Targets Citation Details In-Document Search Title: High-Z Non-Equilibrium Physics and Bright X-ray Sources with New Laser Targets You are ...
Equilibrium and heat of adsorption of diethyl phthalate on heterogeneous adsorbents
Zhang, W.M.; Xu, Z.W.; Pan, B.C.; Hong, C.H.; Jia, K.; Jiang, P.J.; Zhang, Q.J.; Pan, B.J.
2008-09-15
Removal of phthalate esters from water has been of considerable concern recently. In the present study, the adsorptive removal performance of diethyl phthalate (DEP) from water was investigated with the aminated polystyrene resin (NDA-101) and oxidized polystyrene resin (NDA-702). In addition, the commercial homogeneous polystyrene resin (XAD-4) and acrylic ester resin (Amberlite XAD-7) as well as coal-based granular activated carbon (AC-750) were chosen for comparison. The corresponding equilibrium isotherms are well described by the Freundlich equation and the adsorption capacities for DEP followed the order NDA-702 > NDA-101 > AC-750 > XAD-4 > XAD-7. Analysis of adsorption mechanisms suggested that these adsorbents spontaneously adsorb DEP molecules driven mainly by enthalpy change, and the adsorption process was derived by multiple adsorbent-adsorbate interactions such as hydrogen bonding, {pi}-{pi} stacking, and micropore filling. The information related to the adsorbent surface heterogeneity and the adsorbate-adsorbate interaction was obtained by Do's model. All the results indicate that heterogeneous resins NDA-702 and NDA-101 have excellent potential as an adsorption material for the removal of DEP from the contaminated water.
Equilibrium paradigm for field-reversed configurations and application to experiments
Steinhauer, Loren C.; Intrator, T. P.
2009-07-15
Fresh insights on field-reversed configurations (FRCs) are incorporated in a new paradigm for equilibria. In particular four new or unappreciated properties are accounted for: an empirically based scrape-off layer thickness; a new, more accurate axial force balance relation; viscous force regularity at the O-point; and the broken-surface effect. The new paradigm corrects glaring defects of previous models (rigid rotor, Hill's vortex). Further, the new paradigm is simple enough to be easily used as an interpretive tool despite the limited data suite in most experiments. It is applied to the newly enhanced FRC data compendium, a database of 69 records from 15 facilities. Several important observations and corrections on the previous understanding of FRCs follow, three of which stand out. (1) The traditional axial force balance ('average-{beta}' relation) gives an inaccurate scaling with the separatrix-to-wall radius ratio. (2) The improved equilibrium paradigm yields separatrix particle transport rates of 3-5 m{sup 2}/s for 'best confinement' examples; this is a factor of three lower than crude 'bulk' estimates commonly used. (3) The transport compared to the Bohm rate shows a great deal of scatter (40% scatter/mean ratio), i.e., 'Bohm' is not a useful representation for transport scaling.
Cannon, Cody; Wood, Thomas; Neupane, Ghanashyam; McLing, Travis; Mattson, Earl; Dobson, Patrick; Conrad, Mark
2014-10-01
The Eastern Snake River Plain (ESRP) is an area of high regional heat flux due the movement of the North American Plate over the Yellowstone Hotspot beginning ca.16 Ma. Temperature gradients between 45-60 °C/km (up to double the global average) have been calculated from deep wells that penetrate the upper aquifer system (Blackwell 1989). Despite the high geothermal potential, thermal signatures from hot springs and wells are effectively masked by the rapid flow of cold groundwater through the highly permeable basalts of the Eastern Snake River Plain aquifer (ESRPA) (up to 500+ m thick). This preliminary study is part of an effort to more accurately predict temperatures of the ESRP deep thermal reservoir while accounting for the effects of the prolific cold water aquifer system above. This study combines the use of traditional geothermometry, mixing models, and a multicomponent equilibrium geothermometry (MEG) tool to investigate the geothermal potential of the ESRP. In March, 2014, a collaborative team including members of the University of Idaho, the Idaho National Laboratory, and the Lawrence Berkeley National Laboratory collected 14 thermal water samples from and adjacent to the Eastern Snake River Plain. The preliminary results of chemical analyses and geothermometry applied to these samples are presented herein.
On the time needed to reach an equilibrium structure of the radiation belts
Ripoll, J. -F.; Loran, V.; Cunningham, Gregory Scott; Reeves, Geoffrey D.; Shprits, Y. Y.
2016-06-04
In this paper, we complement the notion of equilibrium states of the radiation belts with a discussion on the dynamics and time needed to reach equilibrium. We solve for the equilibrium states obtained using 1D radial diffusion with recently developed hiss and chorus lifetimes at constant values of Kp = 1, 3 and 6. We find that the equilibrium states at moderately low Kp, when plotted vs L-shell (L) and energy (E), display the same interesting S-shape for the inner edge of the outer belt as recently observed by the Van Allen Probes. The S-shape is also produced as themore » radiation belts dynamically evolve toward the equilibrium state when initialized to simulate the buildup after a massive dropout or to simulate loss due to outward diffusion from a saturated state. Physically, this shape, intimately linked with the slot structure, is due to the dependence of electron loss rate (originating from wave-particle interactions) on both energy and L-shell. Equilibrium electron flux profiles are governed by the Biot number (τDiffusion/τloss), with large Biot number corresponding to low fluxes and low Biot number to large fluxes. The time it takes for the flux at a specific (L, E) to reach the value associated with the equilibrium state, starting from these different initial states, is governed by the initial state of the belts, the property of the dynamics (diffusion coefficients), and the size of the domain of computation. Its structure shows a rather complex scissor form in the (L, E) plane. The equilibrium value (phase space density or flux) is practically reachable only for selected regions in (L, E) and geomagnetic activity. Convergence to equilibrium requires hundreds of days in the inner belt for E > 300 keV and moderate Kp (≤3). It takes less time to reach equilibrium during disturbed geomagnetic conditions (Kp ≥ 3), when the system evolves faster. Restricting our interest to the slot region, below L = 4, we find that only small regions in (L, E) space
Glavatskiy, K. S.
2015-10-28
Validity of local equilibrium has been questioned for non-equilibrium systems which are characterized by delayed response. In particular, for systems with non-zero thermodynamic inertia, the assumption of local equilibrium leads to negative values of the entropy production, which is in contradiction with the second law of thermodynamics. In this paper, we address this question by suggesting a variational formulation of irreversible evolution of a system with non-zero thermodynamic inertia. We introduce the Lagrangian, which depends on the properties of the normal and the so-called “mirror-image” systems. We show that the standard evolution equations, in particular, the Maxwell-Cattaneo-Vernotte equation, can be derived from the variational procedure without going beyond the assumption of local equilibrium. We also argue that the second law of thermodynamics in non-equilibrium should be understood as a consequence of the variational procedure and the property of local equilibrium. For systems with instantaneous response this leads to the standard requirement of the local instantaneous entropy production being always positive. However, if a system is characterized by delayed response, the formulation of the second law of thermodynamics should be altered. In particular, the quantity, which is always positive, is not the instantaneous entropy production, but the entropy production averaged over a proper time interval.
QUANTUM MECHANICS, GENERAL PHYSICS; 74 ATOMIC AND MOLECULAR PHYSICS...
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of model atoms in fields Milonni, P.W. 71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS; 74 ATOMIC AND MOLECULAR PHYSICS; ATOMS; OPTICAL MODELS; QUANTUM MECHANICS;...
Patton, Edward G.
2015-07-14
This project used a combination of turbulence-resolving large-eddy simulations, single-column modeling (where turbulence is parameterized), and currently available observations to improve, assess, and develop a parameterization of the impact of non-equilibrium wave states and stratification on the buoy-observed winds to establish reliable wind data at the turbine hub-height level. Analysis of turbulence-resolving simulations and observations illuminates the non-linear coupling between the atmosphere and the undulating sea surface. This analysis guides modification of existing boundary layer parameterizations to include wave influences for upward extrapolation of surface-based observations through the turbine layer. Our surface roughness modifications account for the interaction between stratification and the effects of swell’s amplitude and wavelength as well as swell’s relative motion with respect to the mean wind direction. The single-column version of the open source Weather and Research Forecasting (WRF) model (Skamarock et al., 2008) serves as our platform to test our proposed planetary boundary layer parameterization modifications that account for wave effects on marine atmospheric boundary layer flows. WRF has been widely adopted for wind resource analysis and forecasting. The single column version is particularly suitable to development, analysis, and testing of new boundary layer parameterizations. We utilize WRF’s single-column version to verify and validate our proposed modifications to the Mellor-Yamada-Nakanishi-Niino (MYNN) boundary layer parameterization (Nakanishi and Niino, 2004). We explore the implications of our modifications for two-way coupling between WRF and wave models (e.g.,Wavewatch III). The newly implemented parameterization accounting for marine atmospheric boundary layer-wave coupling is then tested in three-dimensional WRF simulations at grid sizes near 1 km. These simulations identify the behavior of simulated winds at the
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WVMinputs-outputs Permalink Gallery Sandia Labs releases wavelet variability model (WVM) Modeling, News, Photovoltaic, Solar Sandia Labs releases wavelet variability model (WVM) ...
Equilibrium studies of oxalate and aluminum containing solutions
Hay, M. S.; King, W. D.; Peters, T. B.; Jones, D. H.
2015-11-01
The Savannah River National Laboratory (SRNL) was tasked to develop data on the solubility and conditions leading to precipitation of sodium oxalate, sodium nitrate, Bayerite (a polymorph of gibbsite, Al(OH)_{3}), and sodium aluminosilicate solids recently found in the Modular Caustic Side Solvent Extraction Unit (MCU). The data generated will be used to improve the OLI Systems thermodynamic database for these compounds allowing better prediction of solids formation by the modeling software in the future.
Restoring Equilibrium to Natural Gas Markets: Can Renewable Energy Help?
Wiser, Ryan; Bolinger, Mark
2005-01-01
Heightened natural gas prices have emerged as a key energy-policy challenge for at least the early part of the 21st century. With the recent run-up in gas prices and the expected continuation of volatile and high prices in the near future, a growing number of voices are calling for increased diversification of energy supplies. Proponents of renewable energy technologies identify these clean energy sources as an important part of the solution. Increased deployment of renewable energy (RE) can hedge natural gas price risk in more than one way, but a recent report by Berkeley Lab evaluates one such benefit in detail: by displacing gas-fired electricity generation, RE reduces natural gas demand and thus puts downward pressure on gas prices. Many recent modeling studies of increased RE deployment have demonstrated that this ''secondary'' effect of lowering natural gas prices could be significant; as a result, this effect is increasingly cited as justification for policies promoting RE. The Berkeley Lab report summarizes recent modeling studies that have evaluated the impact of RE deployment on gas prices, reviews the reasonableness of the results of these studies in light of economic theory and other research, and develops a simple tool that can be used to evaluate the impact of RE on gas prices without relying on a complex national energy model.
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subdivided into the following categories: Reviews Ground State Properties Shell Model Cluster Model Other Theoretical Work Complex Reactions Reactions Involving Pions, Other...
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for 10C is subdivided into the following categories: Reviews Ground State Properties Shell Model Cluster Model Other Theoretical Work Photodisintegration b-decay Complex Reactions...
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9Be is subdivided into the following categories: Ground State Properties Shell Model Cluster Model Theoretical Complex Reactions Beta-Decay Light-Ion and Neutron Induced...
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subdivided into the following categories: Reviews Ground State Properties Shell Model Cluster Model Other Theoretical Work Photo- and Electro-Induced Reactions Atmospheric...
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subdivided into the following categories: Reviews Ground-state Properties Shell Model Cluster Model Other Theoretical Work Elastic and Inelastic Scattering b-decay Nuclear Spatial...
Aerosol indirect effects - general circulation model intercomparison...
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We compute statistical relationships between aerosol optical depth (a) and various cloud ... Nevertheless, the strengths of the statistical relationships are good predictors for the ...
General Restaurant Equipment: Order (2013-CE-5344)
DOE ordered General Restaurant Equipment Co. to pay a $8,000 civil penalty after finding General Restaurant Equipment had failed to certify that certain models of walk-in cooler and freezer components comply with the applicable energy conservation standards.
Climate Models from the Joint Global Change Research Institute
DOE Data Explorer [Office of Scientific and Technical Information (OSTI)]
Staff at the Joint Institute develop and use models to simulate the economic and physical impacts of global change policy options. The GCAM, for example, gives analysts insight into how regional and national economies might respond to climate change mitigation policies including carbon taxes, carbon trading, and accelerated deployment of energy technology. Three available models are Phoenix, GCAM, and EPIC. Phoenix is a global, dynamic recursive, computable general equilibrium model that is solved in five-year time steps from 2005 through 2100 and divides the world into twenty-four regions. Each region includes twenty-six industrial sectors. Particular attention is paid to energy production in Phoenix. There are nine electricity-generating technologies (coal, natural gas, oil, biomass, nuclear, hydro, wind, solar, and geothermal) and four additional energy commodities: crude oil, refined oil products, coal, and natural gas. Phoenix is designed to answer economic questions related to international climate and energy policy and international trade. Phoenix replaces the Second Generation Model (SGM) that was formerly used for general equilibrium analysis at JGCRI. GCAM is the Global Change Assessment Model, a partial equilibrium model of the world with 14 regions. GCAM operates in 5 year time steps from 1990 to 2095 and is designed to examine long-term changes in the coupled energy, agriculture/land-use, and climate system. GCAM includes a 151-region agriculture land-use module and a reduced form carbon cycle and climate module in addition to its incorporation of demographics, resources, energy production and consumption. The model has been used extensively in a number of assessment and modeling activities such as the Energy Modeling Forum (EMF), the U.S. Climate Change Technology Program, and the U.S. Climate Change Science Program and IPCC assessment reports. GCAM is now freely available as a community model. The Environmental Policy Integrated Climate (EPIC) Model
Symmetric generalized binomial distributions
Bergeron, H.; Curado, E. M. F.; Instituto Nacional de Cincia e Tecnologia - Sistemas Complexos, Rua Xavier Sigaud 150, 22290-180 - Rio de Janeiro, RJ ; Gazeau, J. P.; APC, UMR 7164, Univ Paris Diderot, Sorbonne Paris Cit, 75205 Paris ; Rodrigues, Ligia M. C. S. E-mail: evaldo@cbpf.br E-mail: ligia@cbpf.br
2013-12-15
In two recent articles, we have examined a generalization of the binomial distribution associated with a sequence of positive numbers, involving asymmetric expressions of probabilities that break the symmetry win-loss. We present in this article another generalization (always associated with a sequence of positive numbers) that preserves the symmetry win-loss. This approach is also based on generating functions and presents constraints of non-negativeness, similar to those encountered in our previous articles.
Office of Energy Efficiency and Renewable Energy (EERE) (indexed site)
1 IAEA General Conference Remarks as Prepared for Delivery Secretary Steven Chu Monday, September 19, 2011 Thank you, Ambassador Feruta. Congratulations on your election as President of this Conference. I also want to thank Director General Amano for his outstanding leadership. I am honored to represent the United States today, and I want to share a message from President Barack Obama: "On behalf of the United States, please accept my best wishes for a successful International Atomic Energy
General Running Jobs Recommendations
U.S. Department of Energy (DOE) all webpages (Extended Search)
General Running Jobs Recommendations General Running Jobs Recommendations Introduction Process affinity (or CPU pinning) means to bind MPI process to a CPU or a range of CPUs on the node. It is important to spread MPI ranks evenly onto different NUMA nodes. Thread affinity forces each process or thread to run on a specific subset of processors, to take advantage of local process state. Correct process and thread affinity is the basis for getting optimal performance. Each Haswell node contains 2
Prediction of non-equilibrium solidification modes in austenitic stainless steel laser welds
Vitek, J.M.; David, S.A.
1993-08-01
A primary austenitic, non-equilibrium mode of solidification can be induced in many 300 series austenitic stainless steels by laser welding and other rapid solidification techniques. The change in solidification mode can often result in a fully austenitic microstructure compared to the two phase ferrite plus austenite microstructure that is commonly found after primary ferrite solidification. A predictive capability for the solidification mode under rapid solidification conditions such as laser welding is needed since the microstructure and properties are closely related to solidification behavior. Conventional constitutional diagrams do not predict with any reliability the change to non-equilibrium austenitic solidification mode. Several means that have been attempted to predict the solidification behavior under extreme conditions are reviewed. The Cr{sub EQ}/Ni{sub EQ} ratio is shown to be unreliable, at least with the equivalence factors commonly used. Theoretical calculations of growth rate competition between ferrite and austenite solidification show promise, but some ambiguity results from inaccuracy in thermophysical material parameters. Use of calculated thermodynamic parameters such as equilibrium and non-equilibrium liquidus and solidus temperatures also shows some promise. However, this approach is not completely satisfactory and reliable either. It is concluded that a reliable and accurate method for predicting the tendency of austenitic stainless steels to solidify in the non-equilibrium mode is not yet available.
Sharma, Rohit; Singh, Kuldip
2014-03-15
In the present work, two cases of thermal plasma have been considered; the ground state plasma in which all the atoms and ions are assumed to be in the ground state and the excited state plasma in which atoms and ions are distributed over various possible excited states. The variation of Z?, frozen isentropic coefficient and the isentropic coefficient with degree of ionization and non-equilibrium parameter ?(= T{sub e}/T{sub h}) has been investigated for the ground and excited state helium and argon plasmas at pressures 1?atm, 10?atm, and 100?atm in the temperature range from 6000?K to 60?000?K. For a given value of non-equilibrium parameter, the relationship of Z? with degree of ionization does not show any dependence on electronically excited states in helium plasma whereas in case of argon plasma this dependence is not appreciable till degree of ionization approaches 2. The minima of frozen isentropic coefficient shifts toward lower temperature with increase of non-equilibrium parameter for both the helium and argon plasmas. The lowering of non-equilibrium parameter decreases the frozen isentropic coefficient more emphatically in helium plasma at high pressures in comparison to argon plasma. The increase of pressure slightly reduces the ionization range over which isentropic coefficient almost remains constant and it does not affect appreciably the dependence of isentropic coefficient on non-equilibrium parameter.
Onboard fuel reformers for fuel cell vehicles: Equilibrium, kinetic and system modeling
Kreutz, T.G.; Steinbugler, M.M.; Ogden, J.M.
1996-12-31
On-board reforming of liquid fuels to hydrogen for use in proton exchange membrane (PEM) fuel cell electric vehicles (FCEVs) has been the subject of numerous investigations. In many respects, liquid fuels represent a more attractive method of carrying hydrogen than compressed hydrogen itself, promising greater vehicle range, shorter refilling times, increased safety, and perhaps most importantly, utilization of the current fuel distribution infrastructure. The drawbacks of on-board reformers include their inherent complexity [for example a POX reactor includes: a fuel vaporizer, a reformer, water-gas shift reactors, a preferential oxidation (PROX) unit for CO cleanup, heat exchangers for thermal integration, sensors and controls, etc.], weight, and expense relative to compressed H{sub 2}, as well as degraded fuel cell performance due to the presence of inert gases and impurities in the reformate. Partial oxidation (POX) of automotive fuels is another alternative for hydrogen production. This paper provides an analysis of POX reformers and a fuel economy comparison of vehicles powered by on-board POX and SRM fuel processors.
Modification for complex-particle emission probability in the pre-equilibrium exciton model
Miao Ron-zhi; Wu Guo-hua; Zheng Wei-han; Liu Jian-ye; Yu Chao-fan; Yu Xie
1986-04-01
Starting from a state density formula that distinguishes between neutrons and protons, we have derived corrections for the emission probability W/sub alphabeta/ for complex particles and the purely combinatorial probability R/sub alphabeta/. The calculated results agree well with experimental data and show clear improvement over previous calculations.
Cardenas, Alfredo E.; Elber, Ron
2014-08-07
Coarse graining of membrane simulations by translating atomistic dynamics to densities and fields with Milestoning is discussed. The space of the membrane system is divided into cells and the different cells are characterized by order parameters presenting the number densities. The dynamics of the order parameters are probed with Milestoning. The methodology is illustrated here for a phospholipid membrane system (a hydrated bilayer of DOPC (1,2-dioleoyl-sn-glycero-3-phosphocholine) lipid molecules). Significant inhomogeneity in membrane internal number density leads to complex free energy landscape and local maps of transition times. Dynamics and distributions of cavities within the membrane assist the permeation of nonpolar solutes such as xenon atoms. It is illustrated that quantitative and detailed dynamics of water transport through DOPC membrane can be analyzed using Milestoning with fields. The reaction space for water transport includes at least two slow variables: the normal to the membrane plane, and the water density.
U.S. Department of Energy (DOE) all webpages (Extended Search)
Modelers at the CRF are developing high-fidelity simulation tools for engine combustion and detailed micro-kinetic, surface chemistry modeling tools for catalyst-based exhaust ...
Direct Monte Carlo simulation of the chemical equilibrium composition of detonation products
Shaw, M.S.
1993-06-01
A new Monte Carlo simulation method has been developed by the author which gives the equilibrium chemical composition of a molecular fluid directly. The usual NPT ensemble (isothermal-isobaric) is implemented with N being the number of atoms instead of molecules. Changes in chemical composition are treated as correlated spatial moves of atoms. Given the interaction potentials between molecular products, ``exact`` EOS points including the equilibrium chemical composition can be determined from the simulations. This method is applied to detonation products at conditions in the region near the Chapman- Jouget state. For the example of NO, it is shown that the CJ detonation velocity can be determined to a few meters per second. A rather small change in cross potentials is shown to shift the chemical equilibrium and the CJ conditions significantly.
The effect of the initial exciton numbers on {sup 54,56}Fe(p, xp) Pre-Equilibrium Reactions
Boeluekdemir, M. H.; Tel, E.; Ayd Latin-Small-Letter-Dotless-I n, A.; Okuducu, S.; Kaplan, A.
2011-02-15
In pre-equilibrium nuclear reactions, the geometry-dependent hybrid model is applied with the use of the neutron and proton densities to investigate the effect of initial exciton numbers on the nucleon emission spectra. The initial exciton numbers calculated with the theoretical neutron and proton densities have been obtained within the Skryme-Hartree-Fock method with SKM* and SLy4 forces on target nuclei in the {sup 54,56}Fe(p, xp) reaction at 61.5-MeV incident proton energy by using a new calculationmethod of Tel et al. Also, the differences between the initial exciton numbers for protons and neutrons as a function of nuclear radius, focusing on systematic discrepancies correlated to differences in the proton and neutron densities have been investigated.
IEFIT - An Interactive Approach to High Temperature Fusion Plasma Magnetic Equilibrium Fitting
Peng, Q.; Schachter, J.; Schissel, D.P.; Lao, L.L.
1999-06-01
An interactive IDL based wrapper, IEFIT, has been created for the magnetic equilibrium reconstruction code EFIT written in FORTRAN. It allows high temperature fusion physicists to rapidly optimize a plasma equilibrium reconstruction by eliminating the unnecessarily repeated initialization in the conventional approach along with the immediate display of the fitting results of each input variation. It uses a new IDL based graphics package, GaPlotObj, developed in cooperation with Fanning Software Consulting, that provides a unified interface with great flexibility in presenting and analyzing scientific data. The overall interactivity reduces the process to minutes from the usual hours.
Effects of a weakly 3-D equilibrium on ideal magnetohydrodynamic instabilities
Hegna, C. C.
2014-07-15
The effect of a small three-dimensional equilibrium distortion on an otherwise axisymmetric configuration is shown to be destabilizing to ideal magnetohydrodynamic modes. The calculations assume that the 3-D fields are weak and that shielding physics is present so that no islands appear in the resulting equilibrium. An eigenfunction that has coupled harmonics of different toroidal mode number is constructed using a perturbation approach. The theory is applied to the case of tokamak H-modes with shielded resonant magnetic perturbations (RMPs) present indicating RMPs can be destabilizing to intermediate-n peeling-ballooning modes.
General Motors sidestream separator
Tessier, R.J.
1981-01-01
On February 15, 1980, the United States Environmental Protection Agency, acting pursuant to Paragraph 113(D) (4) of the Clean Air Act, issued to General Motors an innovative technology order covering fifteen coal-fired spreader-stoker boilers located at six General Motors plants in Ohio. The purpose and effect of this order was to permit General Motors time to develop a new, innovative technique for controlling particulate emissions from the specified boilers before compliance with the federally approved Ohio particulate control regulation was required. This new technology was christened, The Sidestream Separator, by General Motors. It provides a highly cost effective means of reducing particulate emissions below levels currently obtainable with conventionally used high efficiency mechanical collectors. These improvements could prove to be of substantial benefit to many industrial facilities with spreader-stoker coal-fired boilers that cannot be brought into compliance with applicble air pollution regulations except by application of far more expensive and unwieldly electrostatic precipitators (ESP's) or fabric filters (baghouses).
Tang, J. Y.
2015-09-03
The Michaelis–Menten kinetics and the reverse Michaelis–Menten kinetics are two popular mathematical formulations used in many land biogeochemical models to describe how microbes and plants would respond to changes in substrate abundance. However, the criteria of when to use which of the two are often ambiguous. Here I show that these two kinetics are special approximations to the Equilibrium Chemistry Approximation kinetics, which is the first order approximation to the quadratic kinetics that solves the equation of enzyme-substrate complex exactly for a single enzyme single substrate biogeochemical reaction with the law of mass action and the assumption of quasi-steady-state formore » the enzyme-substrate complex and that the product genesis from enzyme-substrate complex is much slower than the equilibration between enzyme-substrate complexes, substrates and enzymes. In particular, I showed that the derivation of the Michaelis–Menten kinetics does not consider the mass balance constraint of the substrate, and the reverse Michaelis–Menten kinetics does not consider the mass balance constraint of the enzyme, whereas both of these constraints are taken into account in the Equilibrium Chemistry Approximation kinetics. By benchmarking against predictions from the quadratic kinetics for a wide range of substrate and enzyme concentrations, the Michaelis–Menten kinetics was found to persistently under-predict the normalized sensitivity ∂ ln v / ∂ ln k2+ of the reaction velocity v with respect to the maximum product genesis rate k2+, persistently over-predict the normalized sensitivity ∂ ln v / ∂ ln k1+ of v with respect to the intrinsic substrate affinity k1+, persistently over-predict the normalized sensitivity ∂ ln v / ∂ ln [ E ]T of v with respect the total enzyme concentration [ E ]T and persistently under-predict the normalized sensitivity ∂ ln v / ∂ ln [ S ]T of v with respect to the total substrate concentration [ S ]T. Meanwhile, the
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Theory. (III) Topical Heading and Key Words Separations: Materials, Devices and ... of Equilibrium Adsorption Isotherms of Water Vapor in Zeolite 3A by means of a ...
Ghatage, Dhairyashil; Tomar, Gaurav Shukla, Ratnesh K.
2015-03-28
Non-equilibrium molecular dynamics (MD) simulations require imposition of non-periodic boundary conditions (NPBCs) that seamlessly account for the effect of the truncated bulk region on the simulated MD region. Standard implementation of specular boundary conditions in such simulations results in spurious density and force fluctuations near the domain boundary and is therefore inappropriate for coupled atomistic-continuum calculations. In this work, we present a novel NPBC model that relies on boundary atoms attached to a simple cubic lattice with soft springs to account for interactions from particles which would have been present in an untruncated full domain treatment. We show that the proposed model suppresses the unphysical fluctuations in the density to less than 1% of the mean while simultaneously eliminating spurious oscillations in both mean and boundary forces. The model allows for an effective coupling of atomistic and continuum solvers as demonstrated through multiscale simulation of boundary driven singular flow in a cavity. The geometric flexibility of the model enables straightforward extension to nonplanar complex domains without any adverse effects on dynamic properties such as the diffusion coefficient.
Generalized constructive tree weights
Rivasseau, Vincent E-mail: adrian.tanasa@ens-lyon.org; Tanasa, Adrian E-mail: adrian.tanasa@ens-lyon.org
2014-04-15
The Loop Vertex Expansion (LVE) is a quantum field theory (QFT) method which explicitly computes the Borel sum of Feynman perturbation series. This LVE relies in a crucial way on symmetric tree weights which define a measure on the set of spanning trees of any connected graph. In this paper we generalize this method by defining new tree weights. They depend on the choice of a partition of a set of vertices of the graph, and when the partition is non-trivial, they are no longer symmetric under permutation of vertices. Nevertheless we prove they have the required positivity property to lead to a convergent LVE; in fact we formulate this positivity property precisely for the first time. Our generalized tree weights are inspired by the Brydges-Battle-Federbush work on cluster expansions and could be particularly suited to the computation of connected functions in QFT. Several concrete examples are explicitly given.
A general formulation for compositional reservoir simulation
Rodriguez, F.; Guzman, J.; Galindo-Nava, A.
1994-12-31
In this paper the authors present a general formulation to solve the non-linear difference equations that arise in compositional reservoir simulation. The general approach here presented is based on newton`s method and provides a systematic approach to generate several formulations to solve the compositional problem, each possessing a different degree of implicitness and stability characteristics. The Fully-Implicit method is at the higher end of the implicitness spectrum while the IMPECS method, implicit in pressure-explicit in composition and saturation, is at the lower end. They show that all methods may be obtained as particular cases of the fully-implicit method. Regarding the matrix problem, all methods have a similar matrix structure; the composition of the Jacobian matrix is however unique in each case, being in some instances amenable to reductions for optimal solution of the matrix problem. Based on this, a different approach to derive IMPECS type methods is proposed; in this case, the whole set of 2nc + 6 equations, that apply in each gridblock, is reduced to a single pressure equation through matrix reduction operations; this provides a more stable numerical scheme, compared to other published IMPCS methods, in which the subset of thermodynamic equilibrium equations is arbitrarily decoupled form the set of gridblock equations to perform such reduction. The authors discuss how the general formulation here presented can be used to formulate and construct an adaptive-implicit compositional simulators. They also present results on the numerical performance of FI, IMPSEC and IMPECS methods on some test problems.
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Office of Inspector General Office of Audits and Inspections Work Plan for FY 2013 Audits Central Audits Division Ecotality Funding Overlap Follow-up on Smart Grid Investment Grant DOE's Loan Program Office's Portfolio Management Office of Fossil Energy's Regional Carbon Sequestration Partnerships Advanced Manufacturing Office's Combined Heat and Power Systems DOE's Management of Contaminated Non-EM Facilities Unneeded Real Estate Review of For-Profit Grantees
General Employee Radiological Training
Office of Energy Efficiency and Renewable Energy (EERE) (indexed site)
_______ Change Notice 1 June 2009 DOE HANDBOOK GENERAL EMPLOYEE RADIOLOGICAL TRAINING U.S. Department of Energy AREA TRNG Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. Not Measurement Sensitive This document is available on the Department of Energy Technical Standards Program Web Site at http://www.hss.energy.gov/nuclearsafety/techstds/ Change 1 DOE-HDBK-1131-2007 Original Change Part 2 page 5 The average annual radiation dose to a
General Employee Radiological Training
Office of Energy Efficiency and Renewable Energy (EERE) (indexed site)
DOE HANDBOOK GENERAL EMPLOYEE RADIOLOGICAL TRAINING U.S. Department of Energy AREA TRNG Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. Not Measurement Sensitive This document is available on the Department of Energy Technical Standards Program Web Site at http://www.hss.energy.gov/nuclearsafety/techstds/ DOE-HDBK-1131-2007 iii Foreword This Handbook describes an implementation process for core training as recommended in chapter 14,
General Employee Radiological Training
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Not Measurement Sensitive DOE-HDBK-1131-2007 December 2007_______ Change Notice 1 Reaffirmed 2013 DOE HANDBOOK GENERAL EMPLOYEE RADIOLOGICAL TRAINING U.S. Department of Energy AREA TRNG Washington, D.C. 20585 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. This document is available on the Department of Energy Technical Standards Program Web Site at http://www.hss.energy.gov/nuclearsafety/techstds/ Change 1 DOE-HDBK-1131-2007 Original Change Part 2 page 5 The
Warner, Jacob A.; Gladkis, Laura G.; Timmers, Heiko; Fitzsimmons, Kathryn E.; Reynolds, Eva M.
2011-06-01
Activity measurements on sediment samples for trapped-charge geological dating using gamma-ray spectroscopy are an important verification of the field-site dose rate determination. Furthermore gamma-ray spectroscopy can check if the natural decay series are in secular equilibrium which is a crucial assumption in such dating. Typically the activities of leading members of the Thorium and Uranium decay series are measured, which requires Germanium detectors with thin windows and good energy resolution in order to effectively detect the associated low energy gamma-rays. Such equipment is not always readily available. The potential of conventional Germanium detectors with thick entrance window has been explored towards routine gamma-ray spectroscopy of sediment samples using higher energy gamma-rays. Alternative isotopes, such as Ac-228 and Pb-212 for the Thorium series, and Pa-234m, Ra-226 and Bi-214 for the Uranium series, have been measured in order to determine the mass-specific activity for the respective series and possibly provide a check of secular equilibrium. In addition to measurements of the K-40 activity, with the alternative approach, the activities of both decay series can be accurately determined. The secular equilibrium condition may be tested for the Thorium series. Measurement accuracy for Pa-234m is, however, not sufficient to permit also a reliable check of equilibrium for the Uranium series.
Magnetic probe response function calibrations for plasma equilibrium reconstructions of CDX-U
Spaleta, J.; Zakharov, L.; Kaita, R.; Majeski, R.; Gray, T.
2006-10-15
A novel response function calibration technique has been developed to account for time-dependent nonaxisymmetric eddy currents near magnetic sensors in toroidal magnetic confinement devices. The response function technique provides a means to cross calibrate against all available external field coil systems to calculate the absolute sensitivity of each magnetic field sensor, even when induced eddy currents are present in the vacuum vessel wall. The response function information derived in the calibration process can be used in equilibrium reconstructions to separate plasma signals from signals due to externally produced eddy currents at magnetic field sensor locations, without invoking localized wall current distribution details. The response function technique was used for the first ever equilibrium reconstructions of spherical torus plasmas, when applied to the Current Drive Experiment-Upgrade (CDX-U) device. In conjunction with the equilibrium and stability code (ESC), equilibria were obtained for recent CDX-U experiments with lithium plasma-facing components. A description of the CDX-U magnetic sensor configuration and the response function calibration technique will be presented along with examples of resulting plasma equilibrium for CDX-U lithium wall operations.
Universality far from equilibrium: From superfluid Bose gases to heavy-ion collisions
Schlichting, S.; Venugopalan, R.; Berges, J.; Boguslavski, K.
2015-02-10
Isolated quantum systems in extreme conditions can exhibit unusually large occupancies per mode. In addition, this over-population gives rise to new universality classes of many-body systems far from equilibrium. We present theoretical evidence that important aspects of non-Abelian plasmas in the ultra-relativistic limit admit a dual description in terms of a Bose condensed scalar field theory.
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Kevin Wu National Renewable Energy Lab US DOE SULI Program, Summer 2016 The United States Department of Energy (DOE)'s Office of Energy Efficiency and Renewable Energy has a mission to transition to a global clean energy economy. Part of this mission focuses on investigating new technologies and system improvements to reduce the cost of wind energy. The Wind-Plant Integrated System Design and Engineering Model (WISDEM) is a set of models made by National Renewable Energy Laboratory (NREL)
Generalized self-dual Chern-Simons vortices
Bazeia, D.; Hora, E. da; Santos, C. dos; Menezes, R.
2010-06-15
We search for vortices in a generalized Abelian Chern-Simons model with a nonstandard kinetic term. We illustrate our results, plotting and comparing several features of the vortex solution of the generalized model with those of the vortex solution found in the standard Chern-Simons model.
GENERAL PRINCIPLES OF AGREEMENT
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PRINCIPLES OF AGREEMENT HWB-14-20 and HWB-14-21 These General Principles of Agreement ("Principles of Agreement") are agreed upon by the New Mexico Environment Department ("NMED"), and the United States Department of Energy ("DOE"), Los Alamos National Security, LLC ("LANS"), and Nuclear Waste Partnership, LLC ("NWP") (collectively, with DOE and LANS, the "DOE Permittees") for the purpose of resolving Compliance Order Nos. HWB-14- 20
Environmental patterns from free trade: Implications from dynamic NAFTA models of Mexico
Gale, L.R.
1994-12-31
Studies of the economic impact on Mexico from joining the North American Free Trade Agreement (NAFTA) point to significant dynamic gains from trade. Few studies, however, have effectively related these changes in economic variables to changes in environmental variables. Using sector-share relationships and projections of income growth from dynamic computable general equilibrium models of Mexico, several possible time paths for carbon dioxide emissions are derived. Various scenarios of trade and investment liberalization and increased fuel efficiency under NAFTA result in simulated pollution paths of carbon dioxide that show a reduction in not only the amount of emissions but also in rate of growth of emissions.
Shah, Nayana
2014-10-15
Recently there has been a lot of excitement generated by the possibility of realizing and detecting Majorana fermions within the arena of condensed matter physics and its potential implication for topological quantum computing. In the pursuit of identifying and understanding the signatures of Majorana fermions in realistic systems, we go beyond the low-energy effective-model descriptions of Majorana bound states to derive non-equilibrium transport properties of a topological superconducting wire in the presence of arbitrarily large applied voltages. By virtue of a microscopic calculation we are able to model the tunnel coupling between the superconducting wire and the metallic leads realistically, study the role of high-energy non-topological excitations, predict how the behavior compares for an increasing number of odd versus even number of sites, and study the evolution across the topological quantum phase transition. We consider the Kitaev model as well as its specific realization in terms of a semiconductor-superconductor hybrid structures. Our results have concrete implications for the experimental search and study of Majorana fermions. Here I provide a brief selected summary of the talk presented during the fourth conference on Nuclei and Mesoscopic Physics (NMP14) which took place during May 5th-9th, 2014 at the National Superconducting Cyclotron Laboratory (NSCL), on the campus of Michigan State University, in East Lansing, Michigan.
General Motors | Open Energy Information
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Motors Jump to: navigation, search Name: General Motors Place: Detroit, MI Website: www.generalmotors.com References: General Motors1 Information About Partnership with NREL...
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Monte Carlo modeling it was found that for noisy signals with a significant background component, accuracy is improved by fitting the total emission data which includes the...
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... Renewable Energy, Research & Capabilities, Wind Energy, Wind News|0 Comments Read More ... Energy, Research & Capabilities, Water Power Sandia Modifies Delft3D Turbine Model ...
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Science and Actuarial Practice" Read More Permalink New Project Is the ACME of Computer Science to Address Climate Change Analysis, Climate, Global Climate & Energy, Modeling, ...
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Though adequate for modeling mean transport, this approach does not address ... Microphysics such as diffusive transport and chemical kinetics are represented by ...
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PVLibMatlab Permalink Gallery Sandia Labs Releases New Version of PVLib Toolbox Modeling, News, Photovoltaic, Solar Sandia Labs Releases New Version of PVLib Toolbox Sandia has ...
Fuel Conditioning Facility Electrorefiner Process Model
DeeEarl Vaden
2005-10-01
The Fuel Conditioning Facility at the Idaho National Laboratory processes spent nuclear fuel from the Experimental Breeder Reactor II using electro-metallurgical treatment. To process fuel without waiting for periodic sample analyses to assess process conditions, an electrorefiner process model predicts the composition of the electrorefiner inventory and effluent streams. For the chemical equilibrium portion of the model, the two common methods for solving chemical equilibrium problems, stoichiometric and non stoichiometric, were investigated. In conclusion, the stoichiometric method produced equilibrium compositions close to the measured results whereas the non stoichiometric method did not.
Generalized conjugate gradient squared
Fokkema, D.R.; Sleijpen, G.L.G.
1994-12-31
In order to solve non-symmetric linear systems of equations, the Conjugate Gradient Squared (CGS) is a well-known and widely used iterative method. In practice the method converges fast, often twice as fast as the Bi-Conjugate Gradient method. This is what you may expect, since CGS uses the square of the BiCG polynomial. However, CGS may suffer from its erratic convergence behavior. The method may diverge or the approximate solution may be inaccurate. BiCGSTAB uses the BiCG polynomial and a product of linear factors in an attempt to smoothen the convergence. In many cases, this has proven to be very effective. Unfortunately, the convergence of BiCGSTAB may stall when a linear factor (nearly) degenerates. BiCGstab({ell}) is designed to overcome this degeneration of linear factors. It generalizes BiCGSTAB and uses both the BiCG polynomial and a product of higher order factors. Still, CGS may converge faster than BiCGSTAB or BiCGstab({ell}). So instead of using a product of linear or higher order factors, it may be worthwhile to look for other polynomials. Since the BiCG polynomial is based on a three term recursion, a natural choice would be a polynomial based on another three term recursion. Possibly, a suitable choice of recursion coefficients would result in method that converges faster or as fast as CGS, but less erratic. It turns out that an algorithm for such a method can easily be formulated. One particular choice for the recursion coefficients leads to CGS. Therefore one could call this algorithm generalized CGS. Another choice for the recursion coefficients leads to BiCGSTAB. It is therefore possible to mix linear factors and some polynomial based on a three term recursion. This way one may get the best of both worlds. The authors will report on their findings.
Non-equilibrium oxidation states of zirconium during early stages of metal oxidation
Ma, Wen; Senanayake, Sanjaya D.; Herbert, F. William; Yildiz, Bilge
2015-03-11
The chemical state of Zr during the initial, self-limiting stage of oxidation on single crystal zirconium (0001), with oxide thickness on the order of 1 nm, was probed by synchrotron x-ray photoelectron spectroscopy. Quantitative analysis of the Zr 3d spectrum by the spectrum reconstruction method demonstrated the formation of Zr1+, Zr2+, and Zr3+ as non-equilibrium oxidation states, in addition to Zr4+ in the stoichiometric ZrO2. This finding resolves the long-debated question of whether it is possible to form any valence states between Zr0 and Zr4+ at the metal-oxide interface. As a result, the presence of local strong electric fields andmore » the minimization of interfacial energy are assessed and demonstrated as mechanisms that can drive the formation of these non-equilibrium valence states of Zr.« less
Schmitt, J. C. Lazerson, S.; Majeski, R.; Bialek, J.
2014-11-15
The Lithium Tokamak eXperiment is a spherical tokamak with a close-fitting low-recycling wall composed of thin lithium layers evaporated onto a stainless steel-lined copper shell. Long-lived non-axisymmetric eddy currents are induced in the shell and vacuum vessel by transient plasma and coil currents and these eddy currents influence both the plasma and the magnetic diagnostic signals that are used as constraints for equilibrium reconstruction. A newly installed set of re-entrant magnetic diagnostics and internal saddle flux loops, compatible with high-temperatures and lithium environments, is discussed. Details of the axisymmetric (2D) and non-axisymmetric (3D) treatments of the eddy currents and the equilibrium reconstruction are presented.
Plasma equilibrium in 3D magnetic confinement systems and soliton theory
Skovoroda, A. A.
2009-08-15
Single-valued conformal flux (magnetic) coordinates can always be introduced on arbitrary toroidal magnetic surfaces. It is shown how such coordinates can be obtained by transforming Boozer magnetic coordinates on the surfaces. The metrics is substantially simplified and the coordinate grid is orthogonalized at the expense of a more complicated representation of the magnetic field in conformal flux coordinates. This in turn makes it possible to introduce complex angular flux coordinates on any toroidal magnetic surface and to develop efficient methods for a complex analysis of the geometry of equilibrium magnetic surfaces. The complex analysis reveals how the plasma equilibrium problem is related to soliton theory. Magnetic surfaces of constant mean curvature are considered to exemplify this relationship.
Horowitz, Jordan M.
2015-07-28
The stochastic thermodynamics of a dilute, well-stirred mixture of chemically reacting species is built on the stochastic trajectories of reaction events obtained from the chemical master equation. However, when the molecular populations are large, the discrete chemical master equation can be approximated with a continuous diffusion process, like the chemical Langevin equation or low noise approximation. In this paper, we investigate to what extent these diffusion approximations inherit the stochastic thermodynamics of the chemical master equation. We find that a stochastic-thermodynamic description is only valid at a detailed-balanced, equilibrium steady state. Away from equilibrium, where there is no consistent stochastic thermodynamics, we show that one can still use the diffusive solutions to approximate the underlying thermodynamics of the chemical master equation.
Schmitt, J. C. [Princeton Plasma Physics Laboratory (PPPL), Princeton, NJ (United States); Bialek, J. [Department of Applied Physics and Applied Mathematics, Columbia University, New York, NY (United States); Lazerson, S. [Princeton Plasma Physics Laboratory (PPPL), Princeton, NJ (United States); Majeski, R. [Princeton Plasma Physics Laboratory (PPPL), Princeton, NJ (United States)
2014-11-01
The Lithium Tokamak eXperiment is a spherical tokamak with a close-fitting low-recycling wall composed of thin lithium layers evaporated onto a stainless steel-lined copper shell. Long-lived non-axisymmetric eddy currents are induced in the shell and vacuum vessel by transient plasma and coil currents and these eddy currents influence both the plasma and the magnetic diagnositc signals that are used as constraints for equilibrium reconstruction. A newly installed set of re-entrant magnetic diagnostics and internal saddle flux loops, compatible with high-temperatures and lithium environments, is discussed. Details of the axisymmetric (2D) and non-axisymmetric (3D) treatments of the eddy currents and the equilibrium reconstruction are presented.
Method and apparatus for maintaining equilibrium in a helical axis stellarator
Reiman, A.; Boozer, A.
1984-10-31
Apparatus for maintaining three-dimensional MHD equilibrium in a plasma contained in a helical axis stellarator includes a resonant coil system, having a configuration such that current therethrough generates a magnetic field cancelling the resonant magnetic field produced by currents driven by the plasma pressure on any given flux surface resonating with the rotational transform of another flux surface in the plasma. Current through the resonant coil system is adjusted as a function of plasma beta.
Method and apparatus for maintaining equilibrium in a helical axis stellarator
Reiman, Allan; Boozer, Allen
1987-01-01
Apparatus for maintaining three-dimensional MHD equilibrium in a plasma contained in a helical axis stellerator includes a resonant coil system, having a configuration such that current therethrough generates a magnetic field cancelling the resonant magnetic field produced by currents driven by the plasma pressure on any given flux surface resonating with the rotational transform of another flux surface in the plasma. Current through the resonant coil system is adjusted as a function of plasma beta.
Laskowski, Gregory Michael
2005-12-01
Flows with strong curvature present a challenge for turbulence models, specifically eddy viscosity type models which assume isotropy and a linear and instantaneous equilibrium relation between stress and strain. Results obtained from three different codes and two different linear eddy viscosity turbulence models are compared to a DNS simulation in order to gain some perspective on the turbulence modeling capability of SIERRA/Fuego. The Fuego v2f results are superior to the more common two-layer k-e model results obtained with both a commercial and research code in terms of the concave near wall behavior predictions. However, near the convex wall, including the separated region, little improvement is gained using the v2f model and in general the turbulent kinetic energy prediction is fair at best.
Nonequilibrium candidate Monte Carlo: A new tool for efficient equilibrium simulation
Nilmeier, Jerome P.; Crooks, Gavin E.; Minh, David D. L.; Chodera, John D.
2011-11-08
Metropolis Monte Carlo simulation is a powerful tool for studying the equilibrium properties of matter. In complex condensed-phase systems, however, it is difficult to design Monte Carlo moves with high acceptance probabilities that also rapidly sample uncorrelated configurations. Here, we introduce a new class of moves based on nonequilibrium dynamics: candidate configurations are generated through a finite-time process in which a system is actively driven out of equilibrium, and accepted with criteria that preserve the equilibrium distribution. The acceptance rule is similar to the Metropolis acceptance probability, but related to the nonequilibrium work rather than the instantaneous energy difference. Our method is applicable to sampling from both a single thermodynamic state or a mixture of thermodynamic states, and allows both coordinates and thermodynamic parameters to be driven in nonequilibrium proposals. While generating finite-time switching trajectories incurs an additional cost, driving some degrees of freedom while allowing others to evolve naturally can lead to large enhancements in acceptance probabilities, greatly reducing structural correlation times. Using nonequilibrium driven processes vastly expands the repertoire of useful Monte Carlo proposals in simulations of dense solvated systems.
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... is unique in its ability to model hot radiating plasmas and cold frag- menting solids. ... equation of state eects and heavy ion fusion beam-to-target energy coupling e ciency. ...
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with application in modeling NDCX-II experiments Wangyi Liu 1 , John Barnard 2 , Alex Friedman 2 , Nathan Masters 2 , Aaron Fisher 2 , Alice Koniges 2 , David Eder 2 1 LBNL, USA, 2...
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NASA Earth at Night Video EC, Energy, Energy Efficiency, Global, Modeling, News & Events, Solid-State Lighting, Videos NASA Earth at Night Video Have you ever wondered what the ...
Zhang, Fan; Parker, Jack C.; Brooks, Scott C; Kim, Young Jin; Tang, Guoping; Jardine, Philip M; Watson, David B
2009-01-01
A surface complexation model describing the sorption of uranyl ions and uranyl carbonate on weak and strong sites was used to analyze experiments on pH-dependent U(VI) sorption to weathered shale/limestone saprolite. Sorption data were collected at two different solid to solution ratios. Various methods of estimating equilibrium reaction coefficients and site densities were investigated. As a first approximation, extractable iron oxides were assumed to behave as ferrihydrite with reaction coefficients as reported by Waite et al. (1994). A generalized composite (GC) approach was then employed with coefficients estimated by an inverse modeling method applied both in a stepwise fashion and simultaneously to whole data set. Uncertainty in model parameters and predictions was lowest using the simultaneous inverse method, but results from the stepwise method were very similar. The generalized reaction network accurately described pH-dependent U(VI) sorption on weathered saprolite between pH 4 to 9.
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The Office of the Assistant General Counsel for General Law (GC-56) provides legal support for non-programmatic issues other than those involving procurement and intellectual property. The office...
Title 1 General Provisions Chapter 5 Common Law; General Rights...
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General Provisions Chapter 5 Common Law; General Rights 3 V.S.A. Section 2809 Jump to: navigation, search OpenEI Reference LibraryAdd to library Legal Document- StatuteStatute:...
Research Laboratories General Motors Corporation General Motors Technical Center
Office of Legacy Management (LM)
. MI. 1-q Research Laboratories General Motors Corporation General Motors Technical Center Warren, Michigan 48090 January 21, 1977 Occupational Health Standards Branch Office of Standards Development U. S. Nuclear Requlatory Commission Washington, D.C. 20555 Attention: Mr. Robert E. Alexander, Chief Dear Mr. Alexander: In 1974, General Motors Corporation acquired a manufacturing plant in Adrian, Michigan. On October 21, 1976, General Motors announced that work would begin immediately to prepare
ON QUIET-TIME SOLAR WIND ELECTRON DISTRIBUTIONS IN DYNAMICAL EQUILIBRIUM WITH LANGMUIR TURBULENCE
Zaheer, S.; Yoon, P. H.
2013-10-01
A recent series of papers put forth a self-consistent theory of an asymptotically steady-state electron distribution function and Langmuir turbulence intensity. The theory was developed in terms of the ? distribution which features Maxwellian low-energy electrons and a non-Maxwellian energetic power-law tail component. The present paper discusses a generalized ? distribution that features a Davydov-Druyvesteyn type of core component and an energetic power-law tail component. The physical motivation for such a generalization is so that the model may reflect the influence of low-energy electrons interacting with low-frequency kinetic Alfvnic turbulence as well as with high-frequency Langmuir turbulence. It is shown that such a solution and the accompanying Langmuir wave spectrum rigorously satisfy the balance requirement between the spontaneous and induced emission processes in both the particle and wave kinetic equations, and approximately satisfy the similar balance requirement between the spontaneous and induced scattering processes, which are nonlinear. In spite of the low velocity modification of the electron distribution function, it is shown that the resulting asymptotic velocity power-law index ?, where f{sub e} ? v {sup ?} is close to the average index observed during the quiet-time solar wind condition, i.e., ? ? O(6.5) whereas ?{sub average} ? 6.69, according to observation.
McCoskey, Jacob K.; Cooke, Gary A.; Herting, Daniel L.
2015-09-23
The purposes of the study described in this document follow; Determine or estimate the thermodynamic equilibrium of gibbsite in contact with two real tank waste supernatant liquids through both dissolution of gibbsite (bottom-up approach) and precipitation of aluminum-bearing solids (top-down approach); determine or estimate the thermodynamic equilibrium of a mixture of gibbsite and real tank waste saltcake in contact with real tank waste supernatant liquid through both dissolution of gibbsite and precipitation of aluminum-bearing solids; and characterize the solids present after equilibrium and precipitation of aluminum-bearing solids.
General Restaurant Equipment: Order (2016-CE-53010) | Department of Energy
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Restaurant Equipment: Order (2016-CE-53010) General Restaurant Equipment: Order (2016-CE-53010) July 15, 2016 DOE ordered General Restaurant Equipment Co. to pay a $16,000 civil penalty after finding General Restaurant Equipment had failed to certify that certain models of walk-in cooler and freezer components comply with the applicable energy conservation standards. The Order adopted a Compromise Agreement, which reflected settlement terms between DOE and General Restaurant Equipment. DOE
Soliton configurations in generalized Mie electrodynamics
Rybakov, Yu. P.
2011-07-15
The generalization of the Mie electrodynamics within the scope of the effective 8-spinor field model is suggested, with the Lagrangian including Higgs-like potential and higher degrees of the invariant A{sub Micro-Sign }A{sup Micro-Sign }. Using special Brioschi 8-spinor identity, we show that the model includes the Skyrme and the Faddeev models as particular cases. We investigate the large-distance asymptotic of static solutions and estimate the electromagnetic contribution to the energy of the localized charged configuration.
Effect of neutrino rest mass on ionization equilibrium freeze-out
Grohs, Evan Bradley; Fuller, George M.; Kishimoto, Chad T.; Paris, Mark W.
2015-12-23
We show how small neutrino rest masses can increase the expansion rate near the photon decoupling epoch in the early Universe, causing an earlier, higher temperature freeze-out for ionization equilibrium compared to the massless neutrino case. This yields a larger free-electron fraction, thereby affecting the photon diffusion length differently than the sound horizon at photon decoupling. This neutrino-mass and recombination effect depends strongly on the neutrino rest masses. Ultimately, though below current sensitivity, this effect could be probed by next-generation cosmic microwave background experiments, giving another observational handle on neutrino rest mass.
Brantley, P S
2005-12-13
The double spherical harmonics angular approximation in the lowest order, i.e. double P{sub 0} (DP{sub 0}), is developed for the solution of time-dependent non-equilibrium grey radiative transfer problems in planar geometry. Although the DP{sub 0} diffusion approximation is expected to be less accurate than the P{sub 1} diffusion approximation at and near thermodynamic equilibrium, the DP{sub 0} angular approximation can more accurately capture the complicated angular dependence near a non-equilibrium radiation wave front. In addition, the DP{sub 0} approximation should be more accurate in non-equilibrium optically thin regions where the positive and negative angular domains are largely decoupled. We develop an adaptive angular technique that locally uses either the DP{sub 0} or P{sub 1} flux-limited diffusion approximation depending on the degree to which the radiation and material fields are in thermodynamic equilibrium. Numerical results are presented for two test problems due to Su and Olson and to Ganapol and Pomraning for which semi-analytic transport solutions exist. These numerical results demonstrate that the adaptive P{sub 1}-DP{sub 0} diffusion approximation can yield improvements in accuracy over the standard P{sub 1} diffusion approximation, both without and with flux-limiting, for non-equilibrium grey radiative transfer.
Brantley, P S
2006-08-08
The double spherical harmonics angular approximation in the lowest order, i.e. double P{sub 0} (DP{sub 0}), is developed for the solution of time-dependent non-equilibrium grey radiative transfer problems in planar geometry. Although the DP{sub 0} diffusion approximation is expected to be less accurate than the P{sub 1} diffusion approximation at and near thermodynamic equilibrium, the DP{sub 0} angular approximation can more accurately capture the complicated angular dependence near a non-equilibrium radiation wave front. In addition, the DP{sub 0} approximation should be more accurate in non-equilibrium optically thin regions where the positive and negative angular domains are largely decoupled. We develop an adaptive angular technique that locally uses either the DP{sub 0} or P{sub 1} flux-limited diffusion approximation depending on the degree to which the radiation and material fields are in thermodynamic equilibrium. Numerical results are presented for two test problems due to Su and Olson and to Ganapol and Pomraning for which semi-analytic transport solutions exist. These numerical results demonstrate that the adaptive P{sub 1}-DP{sub 0} diffusion approximation can yield improvements in accuracy over the standard P{sub 1} diffusion approximation, both without and with flux-limiting, for non-equilibrium grey radiative transfer.
Loth, E.; Tryggvason, G.; Tsuji, Y.; Elghobashi, S. E.; Crowe, Clayton T.; Berlemont, A.; Reeks, M.; Simonin, O.; Frank, Th; Onishi, Yasuo; Van Wachem, B.
2005-09-01
Slurry flows occur in many circumstances, including chemical manufacturing processes, pipeline transfer of coal, sand, and minerals; mud flows; and disposal of dredged materials. In this section we discuss slurry flow applications related to radioactive waste management. The Hanford tank waste solids and interstitial liquids will be mixed to form a slurry so it can be pumped out for retrieval and treatment. The waste is very complex chemically and physically. The ARIEL code is used to model the chemical interactions and fluid dynamics of the waste.
General Atomics (GA) | Princeton Plasma Physics Lab
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General Atomics (GA) Subscribe to RSS - General Atomics (GA) General Atomics Image: General Atomics (GA) The Scorpion's Strategy: "Catch and Subdue" Read more about The Scorpion's...
The model with many moments for relativistic electron beams: A simplified solution
Carrisi, Maria Cristina; Pennisi, Sebastiano
2011-02-15
In the 1980s, Amendt and Weitzner proposed an interesting model capable to describe relativistic electron beams. It concerned 14 independent variables and the closure was obtained by using the entropy and the Einstein relativity principles. As we know from literature, an extension to many moments allows to achieve an improvement in the results. Three years ago, we exhibited a macroscopic model with an arbitrary but fixed number of moments for relativistic extended thermodynamics. Such model was more general than those previously appeared in literature, so it was applicable even to materials different from an electron beam. Subsequently, we found the closure of such model consistent with the entropy and the Einstein relativity principles, up to whatever order with respect to equilibrium. The solution was determined in terms of a family of arbitrary single variable functions arising from integration. Those results have a very complex shape and are very difficult to handle so a simplification is necessary. In this paper we will reach this goal. Furthermore, we will prove that by fixing a certain order n{sub p} with respect to equilibrium and a scalar valued single variable function, appearing at that order, then all the terms appearing at orders n{<=}n{sub p} are determined without introducing any other function. This result has already been found for the nonrelativistic case but its extension to the relativistic framework is not straightforward and it requires a supplementary mathematical tool: the above mentioned simplification in the shape of the solutions.
Kadanoff-Baym equations with non-Gaussian initial conditions: The equilibrium limit
Garny, Mathias; Mueller, Markus Michael
2009-10-15
The nonequilibrium dynamics of quantum fields is an initial-value problem, which can be described by Kadanoff-Baym equations. Typically, and, in particular, when numerical solutions are demanded, these Kadanoff-Baym equations are restricted to Gaussian initial states. However, physical initial states are non-Gaussian correlated initial states. In particular, renormalizability requires the initial state to feature n-point correlations that asymptotically agree with the vacuum correlations at short distances. In order to identify physical nonequilibrium initial states, it is therefore a precondition to describe the vacuum correlations of the interacting theory within the nonequilibrium framework. In this paper, Kadanoff-Baym equations for non-Gaussian correlated initial states describing vacuum and thermal equilibrium are derived from the 2PI effective action. A diagrammatic method for the explicit construction of vacuum and thermal initial correlations from the 2PI effective action is provided. We present numerical solutions of Kadanoff-Baym equations for a real scalar {phi}{sup 4} quantum field theory, which take the thermal initial four-point correlation as the leading non-Gaussian correction into account. We find that this minimal non-Gaussian initial condition yields an approximation to the complete equilibrium initial state that is quantitatively and qualitatively significantly improved as compared to Gaussian initial states.
Non-equilibrium oxidation states of zirconium during early stages of metal oxidation
Ma, Wen; Senanayake, Sanjaya D.; Herbert, F. William; Yildiz, Bilge
2015-03-11
The chemical state of Zr during the initial, self-limiting stage of oxidation on single crystal zirconium (0001), with oxide thickness on the order of 1 nm, was probed by synchrotron x-ray photoelectron spectroscopy. Quantitative analysis of the Zr 3d spectrum by the spectrum reconstruction method demonstrated the formation of Zr^{1+}, Zr^{2+}, and Zr^{3+} as non-equilibrium oxidation states, in addition to Zr^{4+} in the stoichiometric ZrO_{2}. This finding resolves the long-debated question of whether it is possible to form any valence states between Zr^{0} and Zr^{4+} at the metal-oxide interface. As a result, the presence of local strong electric fields and the minimization of interfacial energy are assessed and demonstrated as mechanisms that can drive the formation of these non-equilibrium valence states of Zr.
Metal-anion sorption by chitosan beads: Equilibrium and kinetic studies
Guibal, E.; Milot, C.; Tobin, J.M.
1998-04-01
Chitosan is a well-known biopolymer, whose high nitrogen content confers remarkable ability for the sorption of metal ions from dilute effluents. However, its sorption performance in both equilibrium and kinetic terms is controlled by diffusion processes. Gel bead formation allows an expansion of the polymer network, which improves access to the internal sorption sites and enhances diffusion mechanisms. Molybdate and vanadate recovery using glutaraldehyde cross-linked chitosan beads reaches uptake capacities as high as 7--8 mmol/g, depending on the pH. The optimum pH (3--3.5) corresponded to the predominance range of hydrolyzed polynuclear metal forms and optimum electrostatic attraction. While for beads, particle size does not influence equilibrium, for flakes, increasing sorbent radius significantly decreases uptake capacities to 1.5 mmol/g. Sorption kinetics are mainly controlled by intraparticle diffusion for beads, while for flakes the controlling mechanisms are both external and intraparticle diffusion. The gel conditioning increases the intraparticle diffusivity by 3 orders of magnitude: intraparticle diffusivities range between 10{sup {minus}13} and 10{sup {minus}10} m{sup 2}/min, depending on the sorbent size and the conditioning.
Using the depth-velocity-size diagram to interpret equilibrium bed configurations in river flows
Southard, J.B. (Massachusetts Institute of Technology, Cambridge, MA (USA))
1990-05-01
Data from flume studies that report equilibrium bed configuration as well as water temperature, flow depth, flow velocity, and sediment size were used to develop the best approximation to the relationships among the various bed phases (ripples, dunes, lower regime plane bed, upper regime plane bed, and antidunes) in a three-axis graph (depth-velocity-size diagram) with dimensionless measures of mean flow depth, mean flow velocity, and sediment size along the axis. Relationships are shown in a series of depth-velocity and velocity-size sections through the diagram. Boundaries between bed-phase stability fields are drawn as surfaces that minimize, misplacement of data points. A large subset of the data, for which reliable values of bed shear stress are reported, was also used to represent the stability relationships in a graph of dimensionless boundary shear stress against dimensionless sediment size, but with results less useful for fluvial flow interpretation. The diagram covers about one order of magnitude in flow depth. To be useful for river flows, the diagram must be extrapolated in flow depth by about one more order of magnitude, but this is not a serious problem for approximate work. The depth-velocity-size diagram permits prediction of equilibrium bed configuration in river flows when the approximate flow depth and mean flow velocity are known. Because the diagram is essentially dimensionless, the effect of water temperature (via the fluid viscosity) on the bed configuration is easily accounted for by use of the diagram.
Unraveling hadron structure with generalized parton distributions
Andrei Belitsky; Anatoly Radyushkin
2004-10-01
The recently introduced generalized parton distributions have emerged as a universal tool to describe hadrons in terms of quark and gluonic degrees of freedom. They combine the features of form factors, parton densities and distribution amplitudes - the functions used for a long time in studies of hadronic structure. Generalized parton distributions are analogous to the phase-space Wigner quasi-probability function of non-relativistic quantum mechanics which encodes full information on a quantum-mechanical system. We give an extensive review of main achievements in the development of this formalism. We discuss physical interpretation and basic properties of generalized parton distributions, their modeling and QCD evolution in the leading and next-to-leading orders. We describe how these functions enter a wide class of exclusive reactions, such as electro- and photo-production of photons, lepton pairs, or mesons.
Koliner, J. J.; Boguski, J.; Anderson, J. K.; Hanson, J. D.; Chapman, B. E.; Brower, D. L.; Den Hartog, D. J.; Ding, W. X.; Duff, J. R.; Goetz, J. A.; et al
2016-03-25
In order to characterize the Madison Symmetric Torus (MST) reversed-field pinch(RFP)plasmas that bifurcate to a helical equilibrium, the V3FIT equilibrium reconstruction code was modified to include a conducting boundary. RFPplasmas become helical at a high plasma current, which induces large eddy currents in MST's thick aluminum shell. The V3FIT conducting boundary accounts for the contribution from these eddy currents to external magnetic diagnostic coil signals. This implementation of V3FIT was benchmarked against MSTFit, a 2D Grad-Shafranov solver, for axisymmetric plasmas. The two codes both fit B measurement loops around the plasma minor diameter with qualitative agreement between each other andmore » the measured field. Fits in the 3D case converge well, with q-profile and plasma shape agreement between two distinct toroidal locking phases. Greater than 60% of the measured n = 5 component of B at r = a is due to eddy currents in the shell, as calculated by the conducting boundary model.« less
General Biodiesel | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
Biodiesel Jump to: navigation, search Name: General Biodiesel Address: 4034 West Marginal Way Place: Seattle, Washington Zip: 98106 Region: Pacific Northwest Area Sector: Biofuels...
Singularities of Generalized Parton Distributions
Anatoly Radyushkin
2012-05-14
The basic ideas of the theory of Generalized Parton Distributions (GPDs) are reviewed. Recent developments in the study of singularities of GPDs are discussed.
General Atomics | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
Product: General Atomics offers research, development and consulting services to the nuclear industry, including nuclear energy production, manufacturing, defense and related...
AES Exhibit A General Conditions
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SFS Exhibit A General Conditions
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AES Exhibit A General Conditions
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Access to generalized parton distributions at COMPASS
Nowak, Wolf-Dieter
2015-04-10
A brief experimentalist's introduction to Generalized Parton Distributions (GPDs) is given. Recent COMPASS results are shown on transverse target-spin asymmetries in hard exclusive ρ{sup 0} production and their interpretation in terms of a phenomenological model as indication for chiral-odd, transverse GPDs is discussed. For deeply virtual Compton scattering, it is briefly outlined how to access GPDs and projections are shown for future COMPASS measurements.
Xiao, Yong; Holod, Ihor; Wang, Zhixuan; Lin, Zhihong; Zhang, Taige
2015-02-15
Developments in gyrokinetic particle simulation enable the gyrokinetic toroidal code (GTC) to simulate turbulent transport in tokamaks with realistic equilibrium profiles and plasma geometry, which is a critical step in the code–experiment validation process. These new developments include numerical equilibrium representation using B-splines, a new Poisson solver based on finite difference using field-aligned mesh and magnetic flux coordinates, a new zonal flow solver for general geometry, and improvements on the conventional four-point gyroaverage with nonuniform background marker loading. The gyrokinetic Poisson equation is solved in the perpendicular plane instead of the poloidal plane. Exploiting these new features, GTC is able to simulate a typical DIII-D discharge with experimental magnetic geometry and profiles. The simulated turbulent heat diffusivity and its radial profile show good agreement with other gyrokinetic codes. The newly developed nonuniform loading method provides a modified radial transport profile to that of the conventional uniform loading method.
EFS Exhibit A General Conditions
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SFS Exhibit A General Conditions
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SFS Exhibit A General Conditions
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2, 6/14/13) Exhibit A General Conditions Page 1 of 16 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-1 DEFINITIONS (Aug 2012) .......................................................................................................... 3 GC-2A AUTHORIZED REPRESENTATIVES, COMMUNICATIONS AND NOTICES (Jan 2010) ........................................................................................................................................... 3 GC-3 INDEPENDENT
AES Exhibit A General Conditions
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AES Exhibit A General Conditions
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2, 3/6/15) Exhibit A General Conditions Page 1 of 8 EXHIBIT "A" GENERAL CONDITIONS TABLE OF CONTENTS GC Title Page GC-1C DEFINITIONS (Jun 2010) ........................................................................................................... 2 GC-6C ORDER OF PRECEDENCE (Mar 2012) .................................................................................... 2 GC-8B COMPLIANCE WITH LAWS, RULES, REGULATIONS AND STANDARDS (Jun 2010) .......... 2 GC-11 NEW MEXICO GROSS
LFS Exhibit A General Conditions
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LFS Exhibit A General Conditions
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LFS Exhibit A General Conditions
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LFS Exhibit A General Conditions
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CPFFS Exhibit A General Conditions
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CPFFS Exhibit A General Conditions
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CPFFS Exhibit A General Conditions
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CPFFS Exhibit A General Conditions
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Bihani, Abhishek; Daigle, Hugh; Cook, Ann; Glosser, Deborah; Shushtarian, Arash
2015-12-15
Coexistence of three methane phases (liquid (L), gas (G), hydrate (H)) in marine gas hydrate systems may occur according to in-situ pressure, temperature, salinity and pore size. In sediments with salinity close to seawater, a discrete zone of three-phase (3P) equilibrium may occur near the base of the regional hydrate stability zone (RHSZ) due to capillary effects. The existence of a 3P zone influences the location of the bottom-simulating reflection (BSR) and has implications for methane fluxes at the base of the RHSZ. We studied hydrate stability conditions in two wells, WR313-G and WR313-H, at Walker Ridge Block 313 in the northern Gulf of Mexico. We determined pore size distributions (PSD) by constructing a synthetic nuclear magnetic resonance (NMR) relaxation time distribution. Correlations were obtained by non-linear regression on NMR, gamma ray, and bulk density logs from well KC-151 at Keathley Canyon. The correlations enabled construction of relaxation time distributions for WR313-G and WR313-H, which were used to predict PSD through comparison with mercury injection capillary pressure measurements. With the computed PSD, L+H and L+G methane solubility was determined from in-situ pressure and temperature. The intersection of the L+G and L+H curves for various pore sizes allowed calculation of the depth range of the 3P equilibrium zone. As in previous studies at Blake Ridge and Hydrate Ridge, the top of the 3P zone moves upwards with increasing water depth and overlies the bulk 3P equilibrium depth. In clays at Walker Ridge, the predicted thickness of the 3P zone is approximately 35 m, but in coarse sands it is only a few meters due to the difference in absolute pore sizes and the width of the PSD. The thick 3P zone in the clays may explain in part why the BSR is only observed in the sand layers at Walker Ridge, although other factors may influence the presence or absence of a BSR.
Design of a boiling water reactor equilibrium core using thorium-uranium fuel
Francois, J-L.; Nunez-Carrera, A.; Espinosa-Paredes, G.; Martin-del-Campo, C.
2004-10-06
In this paper the design of a Boiling Water Reactor (BWR) equilibrium core using thorium is presented; a heterogeneous blanket-seed core arrangement concept was adopted. The design was developed in three steps: in the first step two different assemblies were designed based on the integrated blanket-seed concept, they are the blanket-dummy assembly and the blanket-seed assembly. The integrated blanketseed concept comes from the fact that the blanket and the seed rods are located in the same assembly, and are burned-out in a once-through cycle. In the second step, a core design was developed to achieve an equilibrium cycle of 365 effective full power days in a standard BWR with a reload of 104 fuel assemblies designed with an average 235U enrichment of 7.5 w/o in the seed sub-lattice. The main operating parameters, like power, linear heat generation rate and void distributions were obtained as well as the shutdown margin. It was observed that the analyzed parameters behave like those obtained in a standard BWR. The shutdown margin design criterion was fulfilled by addition of a burnable poison region in the assembly. In the third step an in-house code was developed to evaluate the thorium equilibrium core under transient conditions. A stability analysis was also performed. Regarding the stability analysis, five operational states were analyzed; four of them define the traditional instability region corner of the power-flow map and the fifth one is the operational state for the full power condition. The frequency and the boiling length were calculated for each operational state. The frequency of the analyzed operational states was similar to that reported for BWRs; these are close to the unstable region that occurs due to the density wave oscillation phenomena in some nuclear power plants. Four transient analyses were also performed: manual SCRAM, recirculation pumps trip, main steam isolation valves closure and loss of feed water. The results of these transients are
The generalized second law of thermodynamics in Ho?ava-Lifshitz cosmology
Jamil, Mubasher; Saridakis, Emmanuel N.; Setare, M.R. E-mail: msaridak@phys.uoa.gr
2010-11-01
We investigate the validity of the generalized second law of thermodynamics in a universe governed by Ho?ava-Lifshitz gravity. Under the equilibrium assumption, that is in the late-time cosmological regime, we calculate separately the entropy time-variation for the matter fluid and, using the modified entropy relation, that of the apparent horizon itself. We find that under detailed balance the generalized second law is generally valid for flat and closed geometry and it is conditionally valid for an open universe, while beyond detailed balance it is only conditionally valid for all curvatures. Furthermore, we also follow the effective approach showing that it can lead to misleading results. The non-complete validity of the generalized second law could either provide a suggestion for its different application, or act as an additional problematic feature of Ho?ava-Lifshitz gravity.
Land-use change trajectories up to 2050: insights from a global agro-economic model comparison
Schmitz, Christoph; van Meijl, Hans; Kyle, G. Page; Nelson, Gerald C.; Fujimori, Shinichiro; Gurgel, Angelo; Havlik, Petr; Heyhoe, Edwina; Mason d'Croz, Daniel; Popp, Alexander; Sands, Ronald; Tabeau, Andrzej; van der Mensbrugghe, Dominique; von Lampe, Martin; Wise, Marshall A.; Blanc, Elodie; Hasegawa, Tomoko; Kavallari, Aikaterini; Valin, Hugo
2014-01-01
Changes in agricultural land use have important implications for environmental services. Previous studies of agricultural land-use futures have been published indicating large uncertainty due to different model assumptions and methodologies. In this article we present a first comprehensive comparison of global agro-economic models that have harmonized drivers of population, GDP, and biophysical yields. The comparison allows us to ask two research questions: (1) How much cropland will be used under different socioeconomic and climate change scenarios? (2) How can differences in model results be explained? The comparison includes four partial and six general equilibrium models that differ in how they model land supply and amount of potentially available land. We analyze results of two different socioeconomic scenarios and three climate scenarios (one with constant climate). Most models (7 out of 10) project an increase of cropland of 1025% by 2050 compared to 2005 (under constant climate), but one model projects a decrease. Pasture land expands in some models, which increase the treat on natural vegetation further. Across all models most of the cropland expansion takes place in South America and sub-Saharan Africa. In general, the strongest differences in model results are related to differences in the costs of land expansion, the endogenous productivity responses, and the assumptions about potential cropland.
Nicholls, David C.; Dopita, Michael A.; Sutherland, Ralph S.; Kewley, Lisa J.; Palay, Ethan
2013-08-15
In this paper we develop tools for observers to use when analyzing nebular spectra for temperatures and metallicities, with two goals: to present a new, simple method to calculate equilibrium electron temperatures for collisionally excited line flux ratios, using the latest atomic data; and to adapt current methods to include the effects of possible non-equilibrium ''{kappa}'' electron energy distributions. Adopting recent collision strength data for [O III], [S III], [O II], [S II], and [N II], we find that existing methods based on older atomic data seriously overestimate the electron temperatures, even when considering purely Maxwellian statistics. If {kappa} distributions exist in H II regions and planetary nebulae as they do in solar system plasmas, it is important to investigate the observational consequences. This paper continues our previous work on the {kappa} distribution. We present simple formulaic methods that allow observers to (1) measure equilibrium electron temperatures and atomic abundances using the latest atomic data, and (2) to apply simple corrections to existing equilibrium analysis techniques to allow for possible non-equilibrium effects. These tools should lead to better consistency in temperature and abundance measurements, and a clearer understanding of the physics of H II regions and planetary nebulae.
Tang, J. Y.
2015-12-01
The Michaelis–Menten kinetics and the reverse Michaelis–Menten kinetics are two popular mathematical formulations used in many land biogeochemical models to describe how microbes and plants would respond to changes in substrate abundance. However, the criteria of when to use either of the two are often ambiguous. Here I show that these two kinetics are special approximations to the equilibrium chemistry approximation (ECA) kinetics, which is the first-order approximation to the quadratic kinetics that solves the equation of an enzyme–substrate complex exactly for a single-enzyme and single-substrate biogeochemical reaction with the law of mass action and the assumption of a quasi-steadymore » state for the enzyme–substrate complex and that the product genesis from enzyme–substrate complex is much slower than the equilibration between enzyme–substrate complexes, substrates, and enzymes. In particular, I show that the derivation of the Michaelis–Menten kinetics does not consider the mass balance constraint of the substrate, and the reverse Michaelis–Menten kinetics does not consider the mass balance constraint of the enzyme, whereas both of these constraints are taken into account in deriving the equilibrium chemistry approximation kinetics. By benchmarking against predictions from the quadratic kinetics for a wide range of substrate and enzyme concentrations, the Michaelis–Menten kinetics was found to persistently underpredict the normalized sensitivity ∂ ln v / ∂ ln k2+ of the reaction velocity v with respect to the maximum product genesis rate k2+, persistently overpredict the normalized sensitivity ∂ ln v / ∂ ln k1+ of v with respect to the intrinsic substrate affinity k1+, persistently overpredict the normalized sensitivity ∂ ln v / ∂ ln [E]T of v with respect the total enzyme concentration [E]T, and persistently underpredict the normalized sensitivity ∂ ln v / ∂ ln [S]T of v with respect to the total substrate concentration
Equilibrium and rate data for the extraction of lipids using compressed carbon dioxide
King, M.B.; Bott, T.R.; Barr, M.J.; Mahmud, R.S.; Sanders, N.
1987-01-01
Equilibrium data are given for the solubilities in compressed CO2 of the lipid components in freshly ground rape seed and of glycerol trioleate (a typical constituent of rape oil) at pressures up to 200 bar and temperatures 25 to 75C. Continuous flow tests in which a bed of ground rape seed was contacted with a stream of liquid CO2 at 25C and varied flow conditions are also reported. The results are collated in terms of an empirical mass transfer coefficient. A sharp change took place in the lipid concentration in the extractant stream leaving the bed when about 65% of the available oil had been extracted. This, and changes in the composition of the extract, are discussed, together with the use of this type of data for design purposes.
Collision integrals for charged-charged interaction in two-temperature non-equilibrium plasma
Ghorui, S.; Das, A. K.
2013-09-15
Choice of an appropriate form of shielding distance in the estimation of collision integrals under screened coulomb potential for two-temperature non-equilibrium plasma is addressed. Simple expressions for collision integrals for charged-charged interactions are derived. It is shown that while some of the formalisms used earlier completely ignore the presence of ions, the others incorporating it may result in negative collision integrals for the interactions involving particles at higher charged states. The parametric regimes of concern and impact of different formalisms on the computed transport properties are investigated with specific reference to nitrogen plasma. A revised definition of the shielding distance is proposed, which incorporates both electrons and ions, avoids the problem of negative collision integrals in all practical regimes of interest and results in calculated property values in close agreement with experimentally observed results.
System and method of adjusting the equilibrium temperature of an inductively-heated susceptor
Matsen, Marc R; Negley, Mark A; Geren, William Preston
2015-02-24
A system for inductively heating a workpiece may include an induction coil, at least one susceptor face sheet, and a current controller coupled. The induction coil may be configured to conduct an alternating current and generate a magnetic field in response to the alternating current. The susceptor face sheet may be configured to have a workpiece positioned therewith. The susceptor face sheet may be formed of a ferromagnetic alloy having a Curie temperature and being inductively heatable to an equilibrium temperature approaching the Curie temperature in response to the magnetic field. The current controller may be coupled to the induction coil and may be configured to adjust the alternating current in a manner causing a change in at least one heating parameter of the susceptor face sheet.
SPEAR fuel reliability code system. General description. [PWR; BWR
Christensen, R.
1980-03-01
A general description is presented for the SPEAR fuel reliability code system. Included is a discussion of the methodology employed and the structure of the code system, as well as discussion of the major components: the data preparation routines, the mechanistic fuel performance model, the mechanistic cladding failure model, and the statistical failure model.
Adsorption characteristics of siloxanes in landfill gas by the adsorption equilibrium test
Nam, Sangchul; Namkoong, Wan; Kang, Jeong-Hee; Park, Jin-Kyu; Lee, Namhoon
2013-10-15
Highlights: • Equilibrium test was attempted to evaluate adsorption characteristics of siloxane. • L2 had higher removal efficiency in carbon compared to noncarbon adsorbents. • Total adsorption capacity of siloxane was 300 mg/g by coal activated carbon. • Adsorption characteristics rely on size of siloxane molecule and adsorbent pore. • Conversion of siloxane was caused by adsorption of noncarbon adsorbents. - Abstract: Due to the increase in energy cost by constantly high oil prices and the obligation to reduce greenhouse effect gases, landfill gas is frequently used as an alternative energy source for producing heat and electricity. Most of landfill gas utility facilities, however, are experiencing problems controlling siloxanes from landfill gas as their catalytic oxidizers are becoming fouled by silicon dioxide dust. To evaluate adsorption characteristics of siloxanes, an adsorption equilibrium test was conducted and parameters in the Freundlich and Langmuir isotherms were analyzed. Coconut activated carbon (CA1), coal activated carbon (CA2), impregnated activated carbon (CA3), silicagel (NCA1), and activated alumina (NCA2) were used for the adsorption of the mixed siloxane which contained hexamethyldisiloxane (L2), octamethylcyclotetrasiloxane (D4), and decamethylcyclopentasiloxane (D5). L2 had higher removal efficiency in noncarbon adsorbents compared to carbon adsorbents. The application of Langmuir and Freundlich adsorption isotherm demonstrated that coconut based CA1 and CA3 provided higher adsorption capacity on L2. And CA2 and NCA1 provided higher adsorption capacity on D4 and D5. Based on the experimental results, L2, D4, and D5 were converted by adsorption and desorption in noncarbon adsorbents. Adsorption affinity of siloxane is considered to be affect by the pore size distribution of the adsorbents and by the molecular size of each siloxane.
Louisiana Title V General Permits
Boyer, B.E.; Neal, T.L.
1995-12-31
Title V of the Federal Clean Air Act Amendments of 1990 requires federal operating permits for all major sources of air pollution. In 1992, Title 40, Part 70 of the Code of Federal Regulations (40 CFR Part 70) codified the law s requirements. These federal regulations, entitled Operating Permit Program, define the minimum requirements for state administered operating permit programs. The intent of Title V is to put into one document all requirements of an operating permit. General Permits for oil and gas facilities may be preferred if the facility can comply with all permit requirements. If greater flexibility than allowed by the General Permit is required, then the facility should apply for an individual Title V permit. General Permits are designed to streamline the permitting process, shorten the time it takes to obtain approval for initial and modified permits. The advantages of the General Permit include reduced paperwork and greater consistency because the permits are standardized. There should be less uncertainty because permit requirements will be known at the time of application. Approval times for Initial and modified General Permits should be reduced. Lengthy public notice procedures (and possible hearings) will be required for only the initial approval of the General Permit and not for each applicant to the permit. A disadvantage of General Permits is reduced flexibility since the facility must comply with the requirements of a standardized permit.
Reeves, Daniel B. Weaver, John B.
2015-06-21
Magnetic nanoparticles are promising tools for a host of therapeutic and diagnostic medical applications. The dynamics of rotating magnetic nanoparticles in applied magnetic fields depend strongly on the type and strength of the field applied. There are two possible rotation mechanisms and the decision for the dominant mechanism is often made by comparing the equilibrium relaxation times. This is a problem when particles are driven with high-amplitude fields because they are not necessarily at equilibrium at all. Instead, it is more appropriate to consider the “characteristic timescales” that arise in various applied fields. Approximate forms for the characteristic time of Brownian particle rotations do exist and we show agreement between several analytical and phenomenological-fit models to simulated data from a stochastic Langevin equation approach. We also compare several approximate models with solutions of the Fokker-Planck equation to determine their range of validity for general fields and relaxation times. The effective field model is an excellent approximation, while the linear response solution is only useful for very low fields and frequencies for realistic Brownian particle rotations.
Axisymmetric general relativistic simulations of the accretion-induced collapse of white dwarfs
Abdikamalov, E. B.; Ott, C. D.; Rezzolla, L.; Dessart, L.; Dimmelmeier, H.; Marek, A.; Janka, H.-T.
2010-02-15
The accretion-induced collapse (AIC) of a white dwarf may lead to the formation of a protoneutron star and a collapse-driven supernova explosion. This process represents a path alternative to thermonuclear disruption of accreting white dwarfs in type Ia supernovae. In the AIC scenario, the supernova explosion energy is expected to be small and the resulting transient short-lived, making it hard to detect by electromagnetic means alone. Neutrino and gravitational-wave (GW) observations may provide crucial information necessary to reveal a potential AIC. Motivated by the need for systematic predictions of the GW signature of AIC, we present results from an extensive set of general-relativistic AIC simulations using a microphysical finite-temperature equation of state and an approximate treatment of deleptonization during collapse. Investigating a set of 114 progenitor models in axisymmetric rotational equilibrium, with a wide range of rotational configurations, temperatures and central densities, and resulting white dwarf masses, we extend previous Newtonian studies and find that the GW signal has a generic shape akin to what is known as a 'type III' signal in the literature. Despite this reduction to a single type of waveform, we show that the emitted GWs carry information that can be used to constrain the progenitor and the postbounce rotation. We discuss the detectability of the emitted GWs, showing that the signal-to-noise ratio for current or next-generation interferometer detectors could be high enough to detect such events in our Galaxy. Furthermore, we contrast the GW signals of AIC and rotating massive star iron core collapse and find that they can be distinguished, but only if the distance to the source is known and a detailed reconstruction of the GW time series from detector data is possible. Some of our AIC models form massive quasi-Keplerian accretion disks after bounce. The disk mass is very sensitive to progenitor mass and angular momentum
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Steven Silbergleid - General Counsel A photo of Steve Silbergleid. As General Counsel, Steve Silbergleid provides legal advice and counsel to the lab's director and executive management on the development and administration of policy, compliance with the prime contract, procurement and intellectual property issues, employment issues, and other legal and management concerns. He also serves as corporate Secretary and provides counsel to the Alliance for Sustainable Energy, L.L.C. (Alliance),
Danielson, Thomas; Hin, Celine; Savara, Aditya
2016-08-10
Lattice based kinetic Monte Carlo (KMC) simulations have been used to determine a functional form for the second order adsorption isotherms on two commonly investigated crystal surfaces: the (111) fluorite surface and the (100) perovskite surface which has the same geometric symmetry as the NaCl (100) surface. The functional form is generalized to be applicable to all values of the equilibrium constant by a shift along the pressure axis. Functions have been determined for estimating the pressure at which a desired coverage would be achieved and for estimating the coverage at a certain pressure. The generalized form has been calculatedmore » by investigating the surface adsorbate coverage across a range of thermodynamic equilibrium constants that span the range 10-26 to 1013. Finally, the equations have been shown to be general for any value of the adsorption equilibrium constant.« less
Tomisaka, Kohji
2014-04-10
Herschel observations have recently revealed that interstellar molecular clouds consist of many filaments. Polarization observations in optical and infrared wavelengths indicate that the magnetic field often runs perpendicular to the filament. In this article, we study the magnetohydrostatic configuration of isothermal gas in which the thermal pressure and the Lorentz force are balanced against the self-gravity, and the magnetic field is globally perpendicular to the axis of the filament. The model is controlled by three parameters: center-to-surface density ratio (? {sub c}/? {sub s}), plasma ? of surrounding interstellar gas (?{sub 0}), and the radius of the hypothetical parent cloud normalized by the scale-height (R{sub 0}{sup ?}), although there remains freedom in how the mass is distributed against the magnetic flux (mass loading). In the case where R{sub 0}{sup ?} is small enough, the magnetic field plays a role in confining the gas. However, the magnetic field generally has the effect of supporting the cloud. There is a maximum line-mass (mass per unit length) above which the cloud is not supported against gravity. Compared with the maximum line-mass of a nonmagnetized cloud (2c{sub s}{sup 2}/G, where c{sub s} and G represent, respectively, the isothermal sound speed and the gravitational constant), that of the magnetized filament is larger than the nonmagnetized one. The maximum line-mass is numerically obtained as ?{sub max}?0.24?{sub cl}/G{sup 1/2}+1.66c{sub s}{sup 2}/G, where ?{sub cl} represents one half of the magnetic flux threading the filament per unit length. The maximum mass of the filamentary cloud is shown to be significantly affected by the magnetic field when the magnetic flux per unit length exceeds ?{sub cl} ? 3 pc ?G (c{sub s} /190 m s{sup 1}){sup 2}.
DePaolo, D.
2010-10-15
A surface reaction kinetic model is developed for predicting Ca isotope fractionation and metal/Ca ratios of calcite as a function of rate of precipitation from aqueous solution. The model is based on the requirements for dynamic equilibrium; i.e. proximity to equilibrium conditions is determined by the ratio of the net precipitation rate (R{sub p}) to the gross forward precipitation rate (R{sub f}), for conditions where ionic transport to the growing crystal surface is not rate-limiting. The value of R{sub p} has been experimentally measured under varying conditions, but the magnitude of R{sub f} is not generally known, and may depend on several factors. It is posited that, for systems with no trace constituents that alter the surface chemistry, R{sub f} can be estimated from the bulk far-from-equilibrium dissolution rate of calcite (R{sub b} or k{sub b}), since at equilibrium R{sub f} = R{sub b}, and R{sub p} = 0. Hence it can be inferred that R{sub f} {approx} R{sub p} + R{sub b}. The dissolution rate of pure calcite is measureable and is known to be a function of temperature and pH. At given temperature and pH, equilibrium precipitation is approached when R{sub p} (= R{sub f} - R{sub b}) << R{sub b}. For precipitation rates high enough that R{sub p} >> R{sub b}, both isotopic and trace element partitioning are controlled by the kinetics of ion attachment to the mineral surface, which tend to favor more rapid incorporation of the light isotopes of Ca and discriminate weakly between trace metals and Ca. With varying precipitation rate, a transition region between equilibrium and kinetic control occurs near R{sub p} {approx} R{sub b} for Ca isotopic fractionation. According to this model, Ca isotopic data can be used to estimate R{sub f} for calcite precipitation. Mechanistic models for calcite precipitation indicate that the molecular exchange rate is not constant at constant T and pH, but rather is dependent also on solution saturation state and hence R{sub p
What is the microscopic response of a system driven far from equilibrium?
Jarzynski, C.
2002-01-01
The central theme of this lecture is that there exists a surprisingly simple and general answer to the question posed in the title, provided that we frame the question statistically. I will present this result along with several derivations, and will discuss some of its implications and generalizations.
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Energy Electric: ENERGY STAR Referral (PFSF5NFZ****) General Electric: ENERGY STAR Referral (PFSF5NFZ****) August 29, 2012 DOE referred the matter of General Electric ("GE") refrigerator-freezer model PFSF5NFZ**** to the U.S. Environmental Protection Agency, brand manager for the ENERGY STAR Program, for appropriate action after DOE testing showed that the model does not meet the ENERGY STAR specification. After referring this matter, DOE determined that GE was also correct that
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General Renewable Energy Technology Resources General Renewable Energy Technology Resources Below are general resources for Tribes on renewable energy technologies. Developing ...
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Privacy Act Guidance General Privacy Act Guidance This document provides information on Privacy Act Requests and responses to general FAQs PDF icon General Privacy Act Guidance ...
FIMP realization of the scotogenic model
Molinaro, Emiliano; Zapata, Oscar; Yaguna, Carlos E. E-mail: carlos.yaguna@uni-muenster.de
2014-07-01
The scotogenic model is one of the simplest scenarios for physics beyond the Standard Model that can account for neutrino masses and dark matter at the TeV scale. It contains another scalar doublet and three additional singlet fermions (N{sub i}), all odd under a Z{sub 2} symmetry. In this paper, we examine the possibility that the dark matter candidate, N{sub 1}, does not reach thermal equilibrium in the early Universe so that it behaves as a Feebly Interacting Massive Particle (FIMP). In that case, it is found that the freeze-in production of dark matter is entirely dominated by the decays of the odd scalars. We compute the resulting dark matter abundance and study its dependence with the parameters of the model. The freeze-in mechanism is shown to be able to account for the observed relic density over a wide range of dark matter masses, from the keV to the TeV scale. In addition to freeze-in, the N{sub 1} relic density receives a further contribution from the late decay of the next-to-lightest odd particle, which we also analyze. Finally, we consider the possibility that the dark matter particle is a WIMP but receives an extra contribution to its relic density from the decay of the FIMP (N{sub 1}). In this case, important signals at direct and indirect detection experiments are generally expected.
?CDM model in f(T) gravity: reconstruction, thermodynamics and stability
Salako, I.G.; Kpadonou, A.V.; Houndjo, M.J.S.; Tossa, J.; Rodrigues, M.E. E-mail: esialg@gmail.com E-mail: sthoundjo@yahoo.fr
2013-11-01
We investigate some cosmological features of the ?CDM model in the framework of the generalized teleparallel theory of gravity f(T) where T denotes the torsion scalar. Its reconstruction is performed giving rise to an integration constant Q and other input parameters according to which we point out more analysis. Thereby, we show that for some values of this constant, the first and second laws of thermodynamics can be realized in the equilibrium description, for the universe with the temperature inside the horizon equal to that at the apparent horizon. Moreover, still within these suitable values of the constant, we show that the model may be stable using the de Sitter and Power-Law cosmological solutions.
Integrated Dynamic Gloabal Modeling of Land Use, Energy and Economic Growth
Atul Jain, University of Illinois, Urbana-Champaign, IL Brian O'Neill, NCAR, Boulder, CO
2009-10-14
The overall objective of this collaborative project is to integrate an existing general equilibrium energy-economic growth model with a biogeochemical cycles and biophysical models in order to more fully explore the potential contribution of land use-related activities to future emissions scenarios. Land cover and land use change activities, including deforestation, afforestation, and agriculture management, are important source of not only CO2, but also non-CO2 GHGs. Therefore, contribution of land-use emissions to total emissions of GHGs is important, and consequently their future trends are relevant to the estimation of climate change and its mitigation. This final report covers the full project period of the award, beginning May 2006, which includes a sub-contract to Brown University later transferred to the National Center for Atmospheric Research (NCAR) when Co-PI Brian O'Neill changed institutional affiliations.
CIM-EARTH: Community integrated model of economic and resource trajectories for humankind.
Elliott, J.; Foster, I.; Judd, K.; Moyer, E.; Munson, T.; Univ. of Chicago; Hoover Inst.
2010-01-01
Climate change is a global problem with local climatic and economic impacts. Mitigation policies can be applied on large geographic scales, such as a carbon cap-and-trade program for the entire U.S., on medium geographic scales, such as the NOx program for the northeastern U.S., or on smaller scales, such as statewide renewable portfolio standards and local gasoline taxes. To enable study of the environmental benefits, transition costs, capitalization effects, and other consequences of mitigation policies, we are developing dynamic general equilibrium models capable of incorporating important climate impacts. This report describes the economic framework we have developed and the current Community Integrated Model of Economic and Resource Trajectories for Humankind (CIM-EARTH) instance.
Relativistic mean-field model with energy dependent self-energies
Antic, S.; Typel, S.
2015-02-24
Conventional relativistic mean-field theory is extended with the introduction of higher-order derivative couplings of nucleons with the meson fields. The Euler-Lagrange equations follow from the principle of stationary action. From invariance principles of the Lagrangian density the most general expressions for the conserved current and energy-momentum tensor are derived. The nucleon self-energies show the explicit dependence on the meson fields. They contain additional regulator functions which describe the energy dependence. The density dependence of meson-nucleon couplings causes the apperance of additional rearrangement contributions in the self-energies. The equation of state of infinite nuclear matter is obtained and the thermodynamical consistency of the model is demonstrated. This model is applied to the description of spherical, non-rotating stars in β-equilibrium. Stellar structure is calculated by solving the Tolman-Oppenheimer-Volkov (TOV) equations. The results for neutron stars are shown in terms of mass-radius relations.
Busigin, A.
2015-03-15
Liquid Phase Catalytic Exchange (LPCE) is a key technology used in water detritiation systems. Rigorous simulation of LPCE is complicated when a column may have both hydrogen and deuterium present in significant concentrations in different sections of the column. This paper presents a general mass transfer model for a homogenous packed bed LPCE column as a set of differential equations describing composition change, and equilibrium equations to define the mass transfer driving force within the column. The model is used to show the effect of deuterium buildup in the bottom of an LPCE column from non-negligible D atom fraction in the bottom feed gas to the column. These types of calculations are important in the design of CECE (Combined Electrolysis and Catalytic Exchange) water detritiation systems.
Li, X; Morgan, A; Davros, W; Dong, F; Primak, A; Segars, W
2014-06-15
Purpose: In CT imaging, a desirable quality assurance (QA) dose quantity should account for the dose variability across scan parameters and scanner models. Recently, AAPM TG 111 proposed to use equilibrium dose-pitch product, in place of CT dose index (CTDI100), for scan modes involving table translation. The purpose of this work is to investigate whether this new concept better accounts for the kVp dependence of organ dose than the conventional CTDI concept. Methods: The adult reference female extended cardiac-torso (XCAT) phantom was used for this study. A Monte Carlo program developed and validated for a 128-slice CT system (Definition Flash, Siemens Healthcare) was used to simulate organ dose for abdomenpelvis scans at five tube voltages (70, 80, 100, 120, 140 kVp) with a pitch of 0.8 and a detector configuration of 2x64x0.6 mm. The same Monte Carlo program was used to simulate CTDI100 and equilibrium dose-pitch product. For both metrics, the central and peripheral values were used together with helical pitch to calculate a volume-weighted average, i.e., CTDIvol and (Deq)vol, respectively. Results: While other scan parameters were kept constant, organ dose depended strongly on kVp; the coefficient of variation (COV) across the five kVp values ranged between 70–75% for liver, spleen, stomach, pancreas, kidneys, colon, small intestine, bladder, and ovaries, all of which were inside the primary radiation beam. One-way analysis of variance (ANOVA) for the effect of kVp was highly significant (p=3e−30). When organ dose was normalized by CTDIvol, the COV across the five kVp values reduced to 7–16%. The effect of kVp was still highly significant (p=4e−4). When organ dose was normalized by (Deq)vol, the COV further reduced to 4−12%. The effect of kVp was borderline significant (p=0.04). Conclusion: In abdomen-pelvis CT, TG 111 equilibrium dose concept better accounts for kVp dependence than the conventional CTDI. This work is supported by a faculty startup
Stout, Ray B.
2008-07-01
Future designs of nuclear fuels require an increased understanding of fission gas bubble density evolution. Derivations will be provided for a generic Boltzmann bubble density evolution equation, a bubble density deformation field equation, and a Cauchy stress/bubble-pressure equilibrium equation. (author)
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A spreadsheet-coupled SOLGAS: A computerized thermodynamic equilibrium calculation tool. Revision 1
Trowbridge, L.D.; Leitnaker, J.M.
1995-07-01
SOLGAS, an early computer program for calculating equilibrium in a chemical system, has been made more user-friendly, and several ``bells and whistles`` have been added. The necessity to include elemental species has been eliminated. The input of large numbers of starting conditions has been automated. A revised spreadsheet-based format for entering data, including non-ideal binary and ternary mixtures, simplifies and reduces chances for error. Calculational errors by SOLGAS are flagged, and several programming errors are corrected. Auxiliary programs are available to assemble and partially automate plotting of large amounts of data. Thermodynamic input data can be changed on line. The program can be operated with or without a co-processor. Copies of the program, suitable for the IBM-PC or compatibles with at least 384 bytes of low RAM, are available from the authors. This user manual contains appendices with examples of the use of SOLGAS. These range from elementary examples, such as, the relationships among water, ice, and water vapor, to more complex systems: phase diagram calculation of UF{sub 4} and UF{sub 6} system; burning UF{sub 4} in fluorine; thermodynamic calculation of the Cl-F-O-H system; equilibria calculations in the CCl{sub 4}--CH{sub 3}OH system; and limitations applicable to aqueous solutions. An appendix also contains the source code.
The deceiving Δ′: On the equilibrium dependent dynamics of nonlinear magnetic islands
Militello, F.; Grasso, D.; Borgogno, D.
2014-10-15
The linear stability parameter Δ′ is commonly used as a figure of merit for the nonlinear dynamics of the tearing mode. It is shown, through numerical simulations, that factors other than Δ′ can play a very important role in determining the evolution of nonlinear magnetic islands, even relatively close to marginal stability. In particular, two different equilibria are analysed and it is shown that, once perturbed, they have a qualitatively and quantitatively different response despite the fact that they are characterised by the same Δ′. However, the different behaviour can still be associated with linear properties of the equilibrium. It is also studied how the nonlinear and saturation phase are affected by an increasing Δ′ in the two equilibria. As the instability drive is increased, the systems move from a dynamics characterised by a “universal” generalised Rutherford equation to a Y-point configuration and then to a plasmoid unstable Y-point. Remarkably, in certain configurations the Rutherford phase is absent and the system forms a current ribbon without an X-point collapse.
Parkin, E. R.; Bicknell, G. V.
2013-02-15
Global three-dimensional magnetohydrodynamic (MHD) simulations of turbulent accretion disks are presented which start from fully equilibrium initial conditions in which the magnetic forces are accounted for and the induction equation is satisfied. The local linear theory of the magnetorotational instability (MRI) is used as a predictor of the growth of magnetic field perturbations in the global simulations. The linear growth estimates and global simulations diverge when nonlinear motions-perhaps triggered by the onset of turbulence-upset the velocity perturbations used to excite the MRI. The saturated state is found to be independent of the initially excited MRI mode, showing that once the disk has expelled the initially net flux field and settled into quasi-periodic oscillations in the toroidal magnetic flux, the dynamo cycle regulates the global saturation stress level. Furthermore, time-averaged measures of converged turbulence, such as the ratio of magnetic energies, are found to be in agreement with previous works. In particular, the globally averaged stress normalized to the gas pressure <{alpha}{sub P}>bar = 0.034, with notably higher values achieved for simulations with higher azimuthal resolution. Supplementary tests are performed using different numerical algorithms and resolutions. Convergence with resolution during the initial linear MRI growth phase is found for 23-35 cells per scale height (in the vertical direction).
Do, Changwoo [ORNL] [ORNL; Chen, Wei-Ren [ORNL] [ORNL; Hong, Kunlun [ORNL] [ORNL; Smith, Gregory Scott [ORNL] [ORNL
2013-01-01
We have performed both mesoscale simulations and neutron scattering experiments on Pluronic L62, a poly(ethylene oxide)-poly(propylene oxide)-poly(ethylene oxide) (PEO-PPO-PEO) triblock copolymer system in aqueous solution. The influence of simulation variables such PEO/PPO block ratio, interaction parameters, and coarse-graining methods is extensively investigated by covering all permutations of parameters found in the literatures. Upon increasing the polymer weight fraction from 50 wt% to 90 wt%, the equilibrium structure of the isotropic, reverse micellar, bicontinuous, worm-like micelle network, and lamellar phases are respectively predicted from the simulation depending on the choices of simulation parameters. Small angle neutron scattering (SANS) measurements show that the same polymer systems exhibit the spherical micellar, lamellar, and reverse micellar phases with the increase of the copolymer concentration at room temperature. Detailed structural analysis and comparison with simulations suggest that one of the simulation parameter sets can provide reasonable agreement with the experimentally observed structures.
First moments of nucleon generalized parton distributions
Wang, P.; Thomas, A. W.
2010-06-01
We extrapolate the first moments of the generalized parton distributions using heavy baryon chiral perturbation theory. The calculation is based on the one loop level with the finite range regularization. The description of the lattice data is satisfactory, and the extrapolated moments at physical pion mass are consistent with the results obtained with dimensional regularization, although the extrapolation in the momentum transfer to t=0 does show sensitivity to form factor effects, which lie outside the realm of chiral perturbation theory. We discuss the significance of the results in the light of modern experiments as well as QCD inspired models.
Brantley, P S
2005-06-06
The double spherical harmonics angular approximation in the lowest order, i.e. double P{sub 0} (DP{sub 0}), is developed for the solution of time-dependent non-equilibrium grey radiative transfer problems in planar geometry. The standard P{sub 1} angular approximation represents the angular dependence of the radiation specific intensity using a linear function in the angular domain -1 {le} {mu} {le} 1. In contrast, the DP{sub 0} angular approximation represents the angular dependence as isotropic in each half angular range -1 {le} {mu} < 0 and 0 < {mu} {le} 1. Neglecting the time derivative of the radiation flux, both the P{sub 1} and DP{sub 0} equations can be written as a single diffusion equation for the radiation energy density. Although the DP{sub 0} diffusion approximation is expected to be less accurate than the P{sub 1} diffusion approximation at and near thermodynamic equilibrium, the DP{sub 0} angular approximation can more accurately capture the complicated angular dependence near the non-equilibrium wave front. We develop an adaptive angular technique that locally uses either the DP{sub 0} or the P{sub 1} diffusion approximation depending on the degree to which the radiation and material fields are in thermodynamic equilibrium. Numerical results are presented for a test problem due to Su and Olson for which a semi-analytic transport solution exists. The numerical results demonstrate that the adaptive P{sub 1}-DP{sub 0} diffusion approximation can yield improvements in accuracy over the standard P{sub 1} diffusion approximation for non-equilibrium grey radiative transfer.
Forcing, feedbacks and climate sensitivity in CMIP5 coupled atmosphere-ocean climate models
Andrews, Timothy; Gregory, Jonathan M.; Webb, Mark J.; Taylor, Karl E.
2012-05-15
We quantify forcing and feedbacks across available CMIP5 coupled atmosphere-ocean general circulation models (AOGCMs) by analysing simulations forced by an abrupt quadrupling of atmospheric carbon dioxide concentration. This is the first application of the linear forcing-feedback regression analysis of Gregory et al. (2004) to an ensemble of AOGCMs. The range of equilibrium climate sensitivity is 2.1–4.7 K. Differences in cloud feedbacks continue to be important contributors to this range. Some models show small deviations from a linear dependence of top-of-atmosphere radiative fluxes on global surface temperature change. We show that this phenomenon largely arises from shortwave cloud radiative effects overmore » the ocean and is consistent with independent estimates of forcing using fixed sea-surface temperature methods. Moreover, we suggest that future research should focus more on understanding transient climate change, including any time-scale dependence of the forcing and/or feedback, rather than on the equilibrium response to large instantaneous forcing.« less
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1 . . General Book 1 Effects Evaluation- for Project Rulison, June 1969 DISCLAIMER Portions of this document may be illegible in electronic image products. Images are produced from the best available original document. . . . . . . . . . . - ,--- ..-... . . . 0 . , . , ~ , . . . . . . . . . . . . . . ... . . I . . . . . . . . . . . . . . . . . . . L . < - ....:.-. . . . . . . . . . . . . . . . . . - , , - . d - i , . .. * :=.:. 5 . . .:. : - . . . . . . : -.. .. ' . . - - .- - : . 7 : P . f l
General purpose programmable accelerator board
Robertson, Perry J.; Witzke, Edward L.
2001-01-01
A general purpose accelerator board and acceleration method comprising use of: one or more programmable logic devices; a plurality of memory blocks; bus interface for communicating data between the memory blocks and devices external to the board; and dynamic programming capabilities for providing logic to the programmable logic device to be executed on data in the memory blocks.
Charged black holes in generalized teleparallel gravity
Rodrigues, M.E.; Houndjo, M.J.S.; Tossa, J.; Momeni, D.; Myrzakulov, R. E-mail: sthoundjo@yahoo.fr E-mail: d.momeni@yahoo.com
2013-11-01
In this paper we investigate charged static black holes in 4D for generalized teleparallel models of gravity, based on torsion as the geometric object for describing gravity according to the equivalence principle. As a motivated idea, we introduce a set of non-diagonal tetrads and derive the full system of non linear differential equations. We prove that the common Schwarzschild gauge is applicable only when we study linear f(T) case. We reobtain the Reissner-Nordstrom-de Sitter (or RN-AdS) solution for the linear case of f(T) and perform a parametric cosmological reconstruction for two nonlinear models. We also study in detail a type of the no-go theorem in the framework of this modified teleparallel gravity.
Veronica J. Rutledge
2013-01-01
The absence of industrial scale nuclear fuel reprocessing in the U.S. has precluded the necessary driver for developing the advanced simulation capability now prevalent in so many other countries. Thus, it is essential to model complex series of unit operations to simulate, understand, and predict inherent transient behavior and feedback loops. A capability of accurately simulating the dynamic behavior of advanced fuel cycle separation processes will provide substantial cost savings and many technical benefits. The specific fuel cycle separation process discussed in this report is the off-gas treatment system. The off-gas separation consists of a series of scrubbers and adsorption beds to capture constituents of interest. Dynamic models are being developed to simulate each unit operation involved so each unit operation can be used as a stand-alone model and in series with multiple others. Currently, an adsorption model has been developed within Multi-physics Object Oriented Simulation Environment (MOOSE) developed at the Idaho National Laboratory (INL). Off-gas Separation and REcoverY (OSPREY) models the adsorption of off-gas constituents for dispersed plug flow in a packed bed under non-isothermal and non-isobaric conditions. Inputs to the model include gas, sorbent, and column properties, equilibrium and kinetic data, and inlet conditions. The simulation outputs component concentrations along the column length as a function of time from which breakthrough data is obtained. The breakthrough data can be used to determine bed capacity, which in turn can be used to size columns. It also outputs temperature along the column length as a function of time and pressure drop along the column length. Experimental data and parameters were input into the adsorption model to develop models specific for krypton adsorption. The same can be done for iodine, xenon, and tritium. The model will be validated with experimental breakthrough curves. Customers will be given access to
Three-dimensional lattice Boltzmann model for magnetic reconnection
Mendoza, M.; Munoz, J. D.
2008-02-15
We develop a three-dimensional (3D) lattice Boltzmann model that recovers in the continuous limit the two-fluids theory for plasmas, and consequently includes the generalized Ohm's law. The model reproduces the magnetic reconnection process just by giving the right initial equilibrium conditions in the magnetotail, without any assumption on the resistivity in the diffusive region. In this model, the plasma is handled similar to two fluids with an interaction term, each one with distribution functions associated to a cubic lattice with 19 velocities (D3Q19). The electromagnetic fields are considered as a third fluid with an external force on a cubic lattice with 13 velocities (D3Q13). The model can simulate either viscous fluids in the incompressible limit or nonviscous compressible fluids, and successfully reproduces both the Hartmann flow and the magnetic reconnection in the magnetotail. The reconnection rate in the magnetotail obtained with this model lies between R=0.062 and R=0.073, in good agreement with the observations.
Generalizing the cosmic energy equation
Shtanov, Yuri; Sahni, Varun
2010-11-15
We generalize the cosmic energy equation to the case when massive particles interact via a modified gravitational potential of the form {phi}(a,r), which is allowed to explicitly depend upon the cosmological time through the expansion factor a(t). Using the nonrelativistic approximation for particle dynamics, we derive the equation for the cosmological expansion which has the form of the Friedmann equation with a renormalized gravitational constant. The generalized Layzer-Irvine cosmic energy equation and the associated cosmic virial theorem are applied to some recently proposed modifications of the Newtonian gravitational interaction between dark-matter particles. We also draw attention to the possibility that the cosmic energy equation may be used to probe the expansion history of the universe thereby throwing light on the nature of dark matter and dark energy.
General Technical Base Qualification Standard
Office of Energy Efficiency and Renewable Energy (EERE) (indexed site)
SENSITIVE DOE-STD-1146-2007 REAFFIRMED: March 2015 DOE STANDARD GENERAL TECHNICAL BASE QUALIFICATION STANDARD DOE Defense Nuclear Facilities Technical Personnel U.S. Department of Energy AREA TRNG Washington, D.C. 20585 DISTRIBUTION STATEMENT A: Approved for public release; distribution is unlimited ii This document is available on the Department of Energy Technical Standards Program Website at http://energy.gov/ehss/services/nuclear-safety/ department-energy-technical-standards-program
Map labeling and its generalizations
Doddi, S. |; Marathe, M.V.; Mirzaian, A.; Moret, B.M.E.; Zhu, B. |
1997-01-01
Map labeling is of fundamental importance in cartography and geographical information systems and is one of the areas targeted for research by the ACM Computational Geometry Impact Task Force. Previous work on map labeling has focused on the problem of placing maximal uniform, axis-aligned, disjoint rectangles on the plane so that each point feature to be labeled lies at the corner of one rectangle. Here, we consider a number of variants of the map labeling problem. We obtain three general types of results. First, we devise constant-factor polynomial-time-approximation algorithms for labeling point features by rectangular labels, where the feature may lie anywhere on the boundary of its label region and where labeling rectangles may be placed in any orientation. These results generalize to the case of elliptical labels. Secondly, we consider the problem of labeling a map consisting of disjoint rectilinear fine segments. We obtain constant-factor polynomial-time approximation algorithms for the general problem and an optimal algorithm for the special case where all segments are horizontal. Finally, we formulate a bicriteria version of the map-labeling problem and provide bicriteria polynomial- time approximation schemes for a number of such problems.
Generalized Gas-Solid Adsorption ...
Office of Scientific and Technical Information (OSTI)
This limitation forces engineers and scientists to test each different model in order to ... isotherms, so it served as a vigorous test of the ability of the codes to handle big data. ...
Nevinitsa, V. A. Dudnikov, A. A.; Blandinskiy, V. Yu.; Balanin, A. L.; Alekseev, P. N.; Titarenko, Yu. E.; Batyaev, V. F.; Pavlov, K. V.; Titarenko, A. Yu.
2015-12-15
A subcritical molten salt reactor with an external neutron source is studied computationally as a facility for incineration and transmutation of minor actinides from spent nuclear fuel of reactors of VVER-1000 type and for producing {sup 233}U from {sup 232}Th. The reactor configuration is chosen, the requirements to be imposed on the external neutron source are formulated, and the equilibrium isotopic composition of heavy nuclides and the key parameters of the fuel cycle are calculated.
A stochastic diffusion process for Lochner's generalized Dirichlet distribution
Bakosi, J.; Ristorcelli, J. R.
2013-10-01
The method of potential solutions of Fokker-Planck equations is used to develop a transport equation for the joint probability of N stochastic variables with Lochner’s generalized Dirichlet distribution as its asymptotic solution. Individual samples of a discrete ensemble, obtained from the system of stochastic differential equations, equivalent to the Fokker-Planck equation developed here, satisfy a unit-sum constraint at all times and ensure a bounded sample space, similarly to the process developed in for the Dirichlet distribution. Consequently, the generalized Dirichlet diffusion process may be used to represent realizations of a fluctuating ensemble of N variables subject to a conservation principle.more » Compared to the Dirichlet distribution and process, the additional parameters of the generalized Dirichlet distribution allow a more general class of physical processes to be modeled with a more general covariance matrix.« less
Shanghai Aerospace Industrial General Corporation aka Shanghai...
Open Energy Information (Open El) [EERE & EIA]
Industrial General Corporation aka Shanghai Academy of Spaceflight Technology Jump to: navigation, search Name: Shanghai Aerospace Industrial General Corporation (aka Shanghai...
Alaska - CPCN General Information | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
CPCN General Information Jump to: navigation, search OpenEI Reference LibraryAdd to library PermittingRegulatory Guidance - Instructions: Alaska - CPCN General...
SWRCB General NPDES Permits | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
NPDES PermitsLegal Abstract SWRCB General NPDES Permits, current through August 14, 2014. Published NA Year Signed or Took Effect 2014 Legal Citation SWRCB General NPDES...
General Information | Photosynthetic Antenna Research Center
U.S. Department of Energy (DOE) all webpages (Extended Search)
General Information General Information Outreach is an integral part of our mission here at PARC. Through various partnerships and the efforts of talented teachers, researchers,...
General Biodiesel Incorporated | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
Biodiesel Incorporated Jump to: navigation, search Name: General Biodiesel Incorporated Place: Seattle, Washington Zip: 98136 Product: General BioDiesel", Inc. specializes in...
General Workforce Restructuring Plan Template | Department of...
Workforce Restructuring Plan Template General Workforce Restructuring Plan Template Attachment 2 - General Workforce Restructuring Plan TemplateRev1 (248.13 KB) More Documents & ...
Texas General Land Office | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
Land Office Jump to: navigation, search Logo: Texas General Land Office Name: Texas General Land Office Address: 1700 Congress Ave Place: Austin, Texas Zip: 78701 Website:...
" Row: General Energy-Management Activities...
U.S. Energy Information Administration (EIA) (indexed site)
of Establishments by Participation in General Energy-Management Activities, 2006;" " Level: National Data; " " Row: General Energy-Management Activities within NAICS Codes;" " ...
" Row: General Energy-Management Activities...
U.S. Energy Information Administration (EIA) (indexed site)
of Establishments by Participation in General Energy-Management Activities, 2010;" " Level: National Data; " " Row: General Energy-Management Activities within NAICS Codes;" " ...
General Construction and Environmental Regulatory Support at...
Office of Energy Efficiency and Renewable Energy (EERE) (indexed site)
General Construction and Environmental Regulatory Support at the Los Alamos National Laboratory General Construction and Environmental Regulatory Support at the Los Alamos National ...
Oregon General Industrial Water Pollution Control Facilities...
Open Energy Information (Open El) [EERE & EIA]
General Industrial Water Pollution Control Facilities Webpage Jump to: navigation, search OpenEI Reference LibraryAdd to library Web Site: Oregon General Industrial Water Pollution...
General Building Spa | Open Energy Information
Open Energy Information (Open El) [EERE & EIA]
Spa Jump to: navigation, search Name: General Building Spa Place: Polverigi - Ancona, Italy Zip: 60020 Product: Ancona based developer of PV projects. References: General Building...
Michigan: General Motors Optimizes Engine Valve Technology |...
Office of Energy Efficiency and Renewable Energy (EERE) (indexed site)
Michigan: General Motors Optimizes Engine Valve Technology Michigan: General Motors Optimizes Engine Valve Technology November 8, 2013 - 12:00am Addthis An EERE-supported effort to ...
Statistical properties of three-dimensional two-fluid plasma model
Qaisrani, M. Hasnain; Xia, ZhenWei; Zou, Dandan
2015-09-15
The nonlinear dynamics of incompressible non-dissipative two-fluid plasma model is investigated through classical Gibbs ensemble methods. Liouville's theorem of phase space for each wave number is proved, and the absolute equilibrium spectra for Galerkin truncated two-fluid model are calculated. In two-fluid theory, the equilibrium is built on the conservation of three quadratic invariants: the total energy and the self-helicities for ions and electrons fluid, respectively. The implications of statistic equilibrium spectra with arbitrary ratios of conserved invariants are discussed.
Cosmology in general massive gravity theories
Comelli, D.; Nesti, F.; Pilo, L. E-mail: fabrizio.nesti@aquila.infn.it
2014-05-01
We study the cosmological FRW flat solutions generated in general massive gravity theories. Such a model are obtained adding to the Einstein General Relativity action a peculiar non derivative potentials, function of the metric components, that induce the propagation of five gravitational degrees of freedom. This large class of theories includes both the case with a residual Lorentz invariance as well as the case with rotational invariance only. It turns out that the Lorentz-breaking case is selected as the only possibility. Moreover it turns out that that perturbations around strict Minkowski or dS space are strongly coupled. The upshot is that even though dark energy can be simply accounted by massive gravity modifications, its equation of state w{sub eff} has to deviate from -1. Indeed, there is an explicit relation between the strong coupling scale of perturbations and the deviation of w{sub eff} from -1. Taking into account current limits on w{sub eff} and submillimiter tests of the Newton's law as a limit on the possible strong coupling scale, we find that it is still possible to have a weakly coupled theory in a quasi dS background. Future experimental improvements on short distance tests of the Newton's law may be used to tighten the deviation of w{sub eff} form -1 in a weakly coupled massive gravity theory.
Model for Energy Supply System Alternatives and their General...
Open Energy Information (Open El) [EERE & EIA]
long term strategies by analysing cost optimal energy mixes, investment needs and other costs for new infrastructure, energy supply security, energy resource utilization, rate of...
Modeling dislocations in a polycrystal using the generalized...
Office of Scientific and Technical Information (OSTI)
Proposed for publication in International Journal of Theoretical and Applied ... Sponsoring Org: USDOE National Nuclear Security Administration (NNSA) Country of ...
Renormalization group equations in a model of generalized hidden...
Office of Scientific and Technical Information (OSTI)
Authors: Hidaka, Yoshimasa ; Morimatsu, Osamu 1 ; Ohtani, Munehisa 2 + Show Author Affiliations Institute of Particle and Nuclear Studies, High Energy Accelerator Research ...
Fast Model Generalized Pseudopotential Theory (MGPT) Interatomic Potential Routine
Energy Science and Technology Software Center (OSTI)
2015-03-18
MGPT is an unclassified source code for the fast evaluation and application of quantum-based MGPT interatomic potentials for mrtals. The present version of MGPT has been developed entirely at LLNL, but is specifically designed for implementation in the open-source molecular0dynamics code LAMMPS maintained by Sandia National Laboratories. Using MGPT in LAMMPS, with separate input potential data, one can perform large-scale atomistic simulations of the structural, thermodynamic, defeat and mechanical properties of transition metals with quantum-mechanicalmore » realism.« less
Generalized Coalescents may be Necessary for Modeling Intrahost...
Office of Scientific and Technical Information (OSTI)
Resource Relation: Conference: HIV Dynamics and Evolution ; 2016-04-24 - 2016-04-27 ; ... Subject: Biological Science; HIV Evolution, coalescent theory Word Cloud More Like This ...
Modeling dislocations in a polycrystal using the generalized...
Office of Scientific and Technical Information (OSTI)
Particular attention will be paid to the effect of grain size on polycrystalline strength. less Authors: Robbins, Joshua H. Publication Date: 2010-06-01 OSTI Identifier: 1044963 ...
System Advisor Model, SAM 2014.1.14: General Description
U.S. Department of Energy (DOE) all webpages (Extended Search)
... for renewable energy projects. SAM simulates the performance of photovoltaic, concentrating solar power, solar water ... * NREL Wind Integration Datasets for wind resource data. * ...
Davtyan, Aram; Dama, James F.; Voth, Gregory A.; Andersen, Hans C.
2015-04-21
Coarse-grained (CG) models of molecular systems, with fewer mechanical degrees of freedom than an all-atom model, are used extensively in chemical physics. It is generally accepted that a coarse-grained model that accurately describes equilibrium structural properties (as a result of having a well constructed CG potential energy function) does not necessarily exhibit appropriate dynamical behavior when simulated using conservative Hamiltonian dynamics for the CG degrees of freedom on the CG potential energy surface. Attempts to develop accurate CG dynamic models usually focus on replacing Hamiltonian motion by stochastic but Markovian dynamics on that surface, such as Langevin or Brownian dynamics. However, depending on the nature of the system and the extent of the coarse-graining, a Markovian dynamics for the CG degrees of freedom may not be appropriate. In this paper, we consider the problem of constructing dynamic CG models within the context of the Multi-Scale Coarse-graining (MS-CG) method of Voth and coworkers. We propose a method of converting a MS-CG model into a dynamic CG model by adding degrees of freedom to it in the form of a small number of fictitious particles that interact with the CG degrees of freedom in simple ways and that are subject to Langevin forces. The dynamic models are members of a class of nonlinear systems interacting with special heat baths that were studied by Zwanzig [J. Stat. Phys. 9, 215 (1973)]. The properties of the fictitious particles can be inferred from analysis of the dynamics of all-atom simulations of the system of interest. This is analogous to the fact that the MS-CG method generates the CG potential from analysis of equilibrium structures observed in all-atom simulation data. The dynamic models generate a non-Markovian dynamics for the CG degrees of freedom, but they can be easily simulated using standard molecular dynamics programs. We present tests of this method on a series of simple examples that demonstrate that
From General Mechanics to General Motors: Lynn Gantt's EcoCAR Experience
Office of Energy Efficiency and Renewable Energy (EERE)
How Lynn Gantt’s EcoCAR experience took him from studying general mechanics to working at General Motors.
Comparison of two-dimensional and three-dimensional MHD equilibrium and stability codes
Herrnegger, F.; Merkel, P.; Johnson, J.L.
1986-02-01
Stability results obtained with the fully three-dimensional magnetohydrodynamic code BETA, the helically invariant code HERA, and the asymptotic stellarator expansion code STEP agree well for a straight l = 2, M = 5 stellarator model. This good agreement between the BETA and STEP codes persists as toroidal curvature is introduced. This validation provides justification for confidence in work with these models. 20 refs., 11 figs.
Inflation in the generalized inverse power law scenario
Lu, Zhun
2013-11-01
We propose a single field inflationary model by generalizing the inverse power law potential from the intermediate model. We study the implication of our model on the primordial anisotropy of cosmological microwave background radiation. Specifically, we apply the slow-roll approximation to calculate the scalar spectral tilt n{sub s} and the tensor-to-scalar ratio r. The results are compared with the recent data measured by the Planck satellite. We find that by choosing proper values for the parameters, our model can well describe the Planck data.
Non-Equilibrium Magnetohydrodynamic Behavior of Plasmas having Complex, Evolving Morphology
Bellan, Paul M.
2014-03-13
Our main activity has been doing lab experiments where plasmas having morphology and behavior similar to solar and astrophysical plasmas are produced and studied. The solar experiment is mounted on one end of a large vacuum chamber while the astrophysical jet experiment is mounted on the other end. Diagnostics are shared between the two experiments. The solar experiment produces arched plasma loops that behave very much like solar corona loops. The astrophysical jet experiment produces plasma jets that are very much like astrophysical jets. We have also done work on plasma waves, including general wave dispersions, and specific properties of kinetic Alfven waves and of whistler waves.
Leaching of BTEX from Aged Crude Oil Contaminated Model Soils: Experimental and Modeling Results
Huesemann, Michael H.; Hausmann, Tom S.; Fortman, Timothy J.
2005-01-01
It is generally assumed that soil properties such as organic matter content, porosity, and mineral surface area have a significant effect on the bioavailability and leachability of aged petroleum hydrocarbons. In order to test this hypothesis, nine model soils or sorbents (i.e., fine and coarse quartz sand, montmorillonite and kaolinite clay, peat, 60? and 150? silica gel, a loam soil, and non-porous glass beads) were spiked with a crude oil, aged for 27 months in the laboratory, and transferred to glass columns for the performance of continuous flow leaching experiments. The column effluents were periodically sampled for 43 days and analyzed for BTEX. A one-dimensional flow model for predicting the dissolution and dispersion of individual hydrocarbons from a multi-component NAPL such as crude oil was used to fit the leaching data (i.e., the BTEX concentration versus time curves) by adjusting the equilibrium oil-leachate partitioning coefficient (Kol) for each respective hydrocarbon. The Peclet number, which is a measure of dispersion and a required modeling parameter, was measured in separate chloride tracer experiments for each soil column. Results demonstrate that soil properties did not significantly affect the leaching kinetics of BTEX from the columns. Instead, BTEX leaching curves could be successfully fitted with the one-dimensional NAPL dissolution flow model for all sorbents with the exception of montmorillonite clay. The fitting parameter Kol for each hydrocarbon was found to be similar to the Kol values that were independently measured for the same crude oil by Rixey et al. (Journal of Hazardous Materials B, 65: 137-156, 1999). In addition, the fitted Kol values were very similar for BTEX leaching from aged compared to freshly spiked loam soil. These findings indicate that leaching of BTEX in the aged soils that are contaminated with crude oil at the high concentrations commonly found in the environment (i.e., >20,000 mg/kg) was not affected by soil