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  1. Hydrolysis of poly(ester urethane): In-depth mechanistic pathway determination through thermal and chemical characterization

    Many structure/property relationships of hydrolyzed poly(ester urethane) (PEU) – a thermoplastic – have been reported. Examples include changes in molecular weight vs. elongation at break and crosslink density vs. mechanical strength. However, the effect of molecular weight (or molar mass) reduction on some physical, thermal, and chemical properties of hydrolyzed PEU have not been reported. Therefore, a large set of hydrolyzed PEU (Estane®5703) samples were obtained from two aging experiments: 1) accelerated aging conducted under various environments (air, nitrogen, moisture) and at 64 °C and below for almost three years, and 2) natural aging conducted under ambient conditions for more than three decades. The hydrolyzed samples were characterized via multi-detection gel permeation chromatography (GPC), thermogravimetric analysis (TGA), modulated differential scanning calorimetry (mDSC), UV–vis spectroscopy, nuclear magnetic resonance (NMR), and Fourier-transform infrared (FTIR) spectroscopy techniques. Hydrolysis of ester linkages in the soft-segments decreases both the molecular weight (Mw) and the melting point (Tm) of Estane (from ~55 °C to 39 °C). Aging above this Tm, increased mobility of polymer chains and water diffusivity in the PEU matrix alter the PEU degradation pathway from those expected at aging temperatures below this Tm and have significant bearing on the critical molecular weight (MC) at which the physical, chemical, thermal, and mechanical properties of Estane change abruptly. While a MC value of 20 kDa is found for PEU hydrolysis at mild temperatures (e.g., as low as 39 °C), the value of MC increases with increasing aging temperatures. To complement the existing structure/property relationships reported in the literature, more correlations are obtained, which include the effect of Mw on polydispersity, intrinsic viscosity (Mark-Houwink equation), UV extinction coefficient, and dn/dc (GPC analysis) values. Furthermore, we seek to bolster previously reported aging models for PEU by developing a practical model with which the extent of degradation and material performance can be predicted based on aging under different temperature ranges both above and below the melting point of Estane.

  2. Optimizing the design and operation of water networks: Two decomposition approaches

    We consider the design and operation of water networks simultaneously. Water network problems can be divided into two categories: the design problem and the operation problem. The design problem involves determining the appropriate pipe sizing and placements of pump stations, while the operation problem involves scheduling pump stations over multiple time periods to account for changes in supply and demand. Our focus is on networks that involve water co-produced with oil and gas. While solving the optimization formulation for such networks, we found that obtaining a primal (feasible) solution is more challenging than obtaining dual bounds using off-the-shelf mixed-integer nonlinear programming solvers. Therefore, we propose two methods to obtain good primal solutions. One method involves a decomposition framework that utilizes a convex reformulation, while the other is based on time decomposition. To test our proposed methods, we conduct computational experiments on a network derived from the PARETO case study.

  3. IROS316456 Smith

    Pantex recognized with EVMS certification

  4. Influence of temperature, oxygen partial pressure, and microstructure on the high-temperature oxidation behavior of the SiC Layer of TRISO particles

    Tristructural isotropic (TRISO)-coated fuel particles are designed for use in high-temperature gas-cooled nuclear reactors, featuring a structural SiC layer that may be exposed to oxygen-rich environments over 1000 °C. Surrogate TRISO particles were tested in 0.2–20 kPa O2 atmospheres to observe the differences in oxidation behavior. Oxide growth mechanisms remained consistent from 1200–1600 °C for each PO$$_2$$, with activation energies of 228 ± 7 kJ/mol for 20 kPa O2 and 188 ± 8 kJ/mol for 0.2 kPa O2. At 1600 °C, kinetic analysis revealed a change in oxide growth mechanisms between 0.2 and 6 kPa O2. In 0.2 kPa O2, oxidation produced raised oxide nodules on pockets with nanocrystalline SiC. Oxidation mechanisms were determined using Atom probe tomography. Active SiC oxidation occurred in C-rich grain boundaries with low PO$$_2$$, leading to SiO2 buildup in porous nodules. Here, this phenomenon was not observed at any temperature in 20 kPa O2 environments.

  5. Phenological control of vegetation biophysical feedbacks to the regional climate

    Phenology shifts influence regional climate by altering energy, and water fluxes through biophysical processes. However, a quantitative understanding of the phenological control on vegetation’s biophysical feedbacks to regional climate remains elusive. Using long-term remote sensing observations and Weather Research and Forecasting (WRF) model simulations, we investigated vegetation phenology changes from 2003 to 2020 and quantified their biophysical controls on the regional climate in Northeast China. Our findings elucidated that earlier green-up contributed to a prolonged growing season in forests, while advanced green-up and delayed dormancy extended the growing season in croplands. This prolonged presence and increased maximum green cover intensified climate-vegetation interactions, resulting in more significant surface cooling in croplands compared to forests. Surface cooling from forest phenology changes was prominent during May’s green-up (-0.53 ± 0.07 °C), while crop phenology changes induced cooling throughout the growing season, particularly in June (-0.47 ± 0.15 °C), July (-0.48 ± 0.11 °C), and September (-0.28 ± 0.09 °C). Furthermore, we unraveled the contributions of different biophysical pathways to temperature feedback using a two-resistance attribution model, with aerodynamic resistance emerging as the dominant factor. Crucially, our findings underscored that the land surface temperature (LST) sensitivity, exhibited substantially higher values in croplands rather than temperate forests. These strong sensitivities, coupled with the projected continuation of phenology shifts, portend further growing season cooling in croplands. These findings contribute to a more comprehensive understanding of the intricate feedback mechanisms between vegetation phenology and surface temperature, emphasizing the significance of vegetation phenology dynamics in shaping regional climate pattern and seasonality.

  6. Final Technical Report for CalWave's xWave Design for PacWave under FOA 2080 for immediate public release.

    Final Technical Report for immediate public release of CalWave's xWave Design for PacWave for microgrids and remote communities.

  7. Working with Bezier Curves as bases for Functional Expansion Tallies

    Functional expansion tallies (FETs) are a powerful tool for getting more information per history from Monte Carlo simulations, but in the past they have been constrained to orthogonal bases. Bezier curves, from computer aided design (CAD), could be well suited for FET due to their ability to assume many arbitrary shapes, but are non-orthogonal. Recent development has made non-orthongal FET possible. The convergence of B ´ezier curve FETs in both polynomial order and number of samples is explored. These bases are well suited for representing normal distributions, and opens the door to possible other CAD derived FET bases.

  8. A Practical guide to Parsing MCNP Inputs: Lessons Learned from Implementing Context-Free Parsing in MontePy

    Monte Carlo N-Particle (MCNP) is a widely used Monte Carlo transport solver that began development in the 1960’s. Due to this MCNP input files uses a custom input syntax, for which there are no off-the-shelf parsing libraries available. For MontePy to create an effective Object-Oriented interface for MCNP input files, an context-free parser was implemented to be able to fully parse the files. MontePy uses a number of shortcuts and optimizations to avoid creating a single universal input file parser. . These lessons can be applied to working with the many other custom input syntax languages persistent throughout the nuclear industry.

  9. Developing a Nuclear Quality Assurance Compliant Design Methodology for Neutronic Analysis of Xe-100 Design

    The primary objective of this work is to develop a design methodology compliant with nuclear quality assurance standards for the Xe-100 neutronic design verification studies. To achieve this, a Monte Carlo model of the Xe-100 reactor was constructed using the exclusion principle, transformation technique, and universe-based level specification following Idaho National Laboratory (INL) NQA level-1 compliant standards and an NQA-1 compliant version of MCNP6. The model encompasses the entire reactor core structures, including the upper plenum, core region, and lower plenum sections, along with all sub-components. The active core section was represented using the spectral regions, each comprising a particular fuel composition and temperature averaged over the considered zone, calculated by X-energy using Very Superior Old Programs (VSOP). Additionally, a component-wise temperature map was implemented into the model, not only for the core region but also for the structural components. Temperature-dependent cross-section libraries, along with thermal scattering law libraries, generated using INL NQA-1 compliant version of NJOY21, were utilized for each isotope in the burnt fuel and the structural materials. Furthermore, the volume of each modeled component was estimated using a stochastic approach with the ray tracing method in MCNP and criticality calculations were performed.

  10. Tungsten erosion during L-mode discharges in the DIII-D SAS-VW divertor

    A series of L-mode plasma discharges was performed in the DIII-D tokamak to assess the impact of outer strike point (OSP) position and toroidal magnetic field direction on erosion and core contamination potential of the recently-installed, tungsten-coated Small Angle Slot (SAS-VW) divertor. In one discharge, in-slot emission spectroscopy measured an <48% increase in the W gross erosion rate when the OSP was moved 3 cm outwards, away from the V-shaped vertex of the slot divertor. However, the effective W yield (erosion rate divided by the incident D flux) was, overall, insensitive to changes in OSP location. Consistently low estimates of the effective W yield based on measurements taken a few cm outwards from the vertex suggest potentially significant C surface contamination. No W emission signal was detected when orienting the toroidal magnetic field such that the ion B×∇B drift direction is pointed away from the X-point. However, measurements of W content in the plasma core for both toroidal magnetic field directions suggest the presence of additional, unmeasured sources of erosion. The difference in the measured core W density with OSP position is much greater than the difference in the measured erosion rates, which may suggest that the leakage of eroded impurities out of the divertor is governed primarily through the parallel ion temperature gradient and friction forces.


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