Review of the second charged-particle transport coefficient code comparison workshop

Stanek, Lucas J.; Kononov, Alina; Hansen, Stephanie B.; Haines, Brian M.; Hu, S. X.; Knapp, Patrick F.; Murillo, Michael S.; Stanton, Liam G.; Whitley, Heather D.; Baalrud, Scott D.; Babati, Lucas J.; Baczewski, Andrew D.; Bethkenhagen, Mandy; Blanchet, Augustin; Clay, III, Raymond C.; Cochrane, Kyle R.; Collins, Lee A.; Dumi, Amanda; Faussurier, Gerald; French, Martin; Johnson, Zachary A.; Karasiev, Valentin V.; Kumar, Shashikant; Lentz, Meghan K.; Melton, Cody A.; Nichols, Katarina A.; Petrov, George M.; Recoules, Vanina; Redmer, Ronald; Röpke, Gerd; Schörner, Maximilian; Shaffer, Nathaniel R.; Sharma, Vidushi; Silvestri, Luciano G.; Soubiran, François; Suryanarayana, Phanish; Tacu, Mikael; Townsend, Joshua P.; White, Alexander J.

doi:10.1063/5.0198155

Title: Review of the second charged-particle transport coefficient code comparison workshop

Journal Article · 01 May 2024 · Physics of Plasmas

DOI: https://doi.org/10.1063/5.0198155 · OSTI ID:2567729

;

We report the results of the second charged-particle transport coefficient code comparison workshop, which was held in Livermore, California on 24–27 July 2023. This workshop gathered theoretical, computational, and experimental scientists to assess the state of computational and experimental techniques for understanding charged-particle transport coefficients relevant to high-energy-density plasma science. Data for electronic and ionic transport coefficients, namely, the direct current electrical conductivity, electron thermal conductivity, ion shear viscosity, and ion thermal conductivity were computed and compared for multiple plasma conditions. Additional comparisons were carried out for electron–ion properties such as the electron–ion equilibration time and alpha particle stopping power. Overall, 39 participants submitted calculated results from 18 independent approaches, spanning methods from parameterized semi-empirical models to time-dependent density functional theory. In the cases studied here, we find significant differences—several orders of magnitude—between approaches, particularly at lower temperatures, and smaller differences—roughly a factor of five—among first-principles models. We investigate the origins of these differences through comparisons of underlying predictions of ionic and electronic structure. The results of this workshop help to identify plasma conditions where computationally inexpensive approaches are accurate, where computationally expensive models are required, and where experimental measurements will have high impact.

View Journal Article

Cite

Export

Save

Research Organization:: Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States); Los Alamos National Laboratory (LANL), Los Alamos, NM (United States); Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States); University of Rochester, NY (United States)

Sponsoring Organization:: USDOE; USDOE Laboratory Directed Research and Development (LDRD) Program; USDOE National Nuclear Security Administration (NNSA)

Grant/Contract Number:: 89233218CNA000001; AC52-07NA27344; NA0003525; NA0004128; NA0004144; NA0004146

OSTI ID:: 2567729

Report Number(s):: LA-UR--24-20300; LLNL--JRNL-859348; SAND--2024-05828J; 052104

Journal Information:: Physics of Plasmas, Journal Name: Physics of Plasmas Journal Issue: 5 Vol. 31; ISSN 1070-664X

Publisher:: American Institute of PhysicsCopyright Statement

Country of Publication:: United States

Language:: English

References (107)

Progress in Measurements of the Electrical Conductivity of Metal Plasmas DeSilva, A. W.; Rakhel, A. D. Contributions to Plasma Physics, Vol. 45, Issue 3-4 https://doi.org/10.1002/ctpp.200510026	journal	July 2005
Stopping of Deuterium in Warm Dense Deuterium from Ehrenfest Time-Dependent Density Functional Theory: Stopping of Deuterium in Warm Dense Deuterium from Ehrenfest Time-Dependent Density Functional Theory Magyar, R. J.; Shulenburger, L.; Baczewski, A. D. Contributions to Plasma Physics, Vol. 56, Issue 5 https://doi.org/10.1002/ctpp.201500143	journal	June 2016
Ab-initio simulations of materials using VASP: Density-functional theory and beyond Hafner, Jürgen Journal of Computational Chemistry, Vol. 29, Issue 13 https://doi.org/10.1002/jcc.21057	journal	October 2008
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set Kresse, G.; Furthmüller, J. Computational Materials Science, Vol. 6, Issue 1, p. 15-50 https://doi.org/10.1016/0927-0256(96)00008-0	journal	July 1996
Calculating electronic stopping power in materials from first principles Correa, Alfredo A. Computational Materials Science, Vol. 150 https://doi.org/10.1016/j.commatsci.2018.03.064	journal	July 2018
SQDFT: Spectral Quadrature method for large-scale parallel O ( N ) Kohn–Sham calculations at high temperature Suryanarayana, Phanish; Pratapa, Phanisri P.; Sharma, Abhiraj Computer Physics Communications, Vol. 224 https://doi.org/10.1016/j.cpc.2017.12.003	journal	March 2018
The Abinitproject: Impact, environment and recent developments Gonze, Xavier; Amadon, Bernard; Antonius, Gabriel Computer Physics Communications, Vol. 248 https://doi.org/10.1016/j.cpc.2019.107042	journal	March 2020
LAMMPS - a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales Thompson, Aidan P.; Aktulga, H. Metin; Berger, Richard Computer Physics Communications, Vol. 271 https://doi.org/10.1016/j.cpc.2021.108171	journal	February 2022
Extended first-principles molecular dynamics model for high temperature simulations in the Abinit code: Application to warm dense aluminum Blanchet, A.; Clérouin, J.; Torrent, M. Computer Physics Communications, Vol. 271 https://doi.org/10.1016/j.cpc.2021.108215	journal	February 2022
Sarkas: A fast pure-python molecular dynamics suite for plasma physics Silvestri, Luciano G.; Stanek, Lucas J.; Dharuman, Gautham Computer Physics Communications, Vol. 272 https://doi.org/10.1016/j.cpc.2021.108245	journal	March 2022
Equation of state, occupation probabilities and conductivities in the average atom Purgatorio code Sterne, P. A.; Hansen, S. B.; Wilson, B. G. High Energy Density Physics, Vol. 3, Issue 1-2 https://doi.org/10.1016/j.hedp.2007.02.037	journal	May 2007
Viscosity estimates of liquid metals and warm dense matter using the Yukawa reference system Murillo, Michael S. High Energy Density Physics, Vol. 4, Issue 1-2 https://doi.org/10.1016/j.hedp.2007.11.001	journal	April 2008
A simple method for determining the ionic structure of warm dense matter Starrett, C. E.; Saumon, D. High Energy Density Physics, Vol. 10 https://doi.org/10.1016/j.hedp.2013.12.001	journal	March 2014
Comparison of electron transport calculations in warm dense matter using the Ziman formula Burrill, D. J.; Feinblum, D. V.; Charest, M. R. J. High Energy Density Physics, Vol. 19 https://doi.org/10.1016/j.hedp.2016.01.004	journal	June 2016
Potential of mean force for electrical conductivity of dense plasmas Starrett, C. E. High Energy Density Physics, Vol. 25 https://doi.org/10.1016/j.hedp.2017.09.003	journal	December 2017
Review of the first charged-particle transport coefficient comparison workshop Grabowski, P. E.; Hansen, S. B.; Murillo, M. S. High Energy Density Physics, Vol. 37 https://doi.org/10.1016/j.hedp.2020.100905	journal	November 2020
SPARC: Simulation Package for Ab-initio Real-space Calculations Xu, Qimen; Sharma, Abhiraj; Comer, Benjamin SoftwareX, Vol. 15 https://doi.org/10.1016/j.softx.2021.100709	journal	July 2021
Inq, a Modern GPU-Accelerated Computational Framework for (Time-Dependent) Density Functional Theory Andrade, Xavier; Pemmaraju, Chaitanya Das; Kartsev, Alexey Journal of Chemical Theory and Computation, Vol. 17, Issue 12 https://doi.org/10.1021/acs.jctc.1c00562	journal	November 2021
Reliable Viscosity Calculation from Equilibrium Molecular Dynamics Simulations: A Time Decomposition Method Zhang, Yong; Otani, Akihito; Maginn, Edward J. Journal of Chemical Theory and Computation, Vol. 11, Issue 8 https://doi.org/10.1021/acs.jctc.5b00351	journal	July 2015
Ultrafast multi-cycle terahertz measurements of the electrical conductivity in strongly excited solids Chen, Z.; Curry, C. B.; Zhang, R. Nature Communications, Vol. 12, Issue 1 https://doi.org/10.1038/s41467-021-21756-6	journal	March 2021
Temperature relaxation in strongly-coupled binary ionic mixtures Sprenkle, R. Tucker; Silvestri, L. G.; Murillo, M. S. Nature Communications, Vol. 13, Issue 1 https://doi.org/10.1038/s41467-021-27696-5	journal	January 2022
Trajectory sampling and finite-size effects in first-principles stopping power calculations Kononov, Alina; Hentschel, Thomas W.; Hansen, Stephanie B. npj Computational Materials, Vol. 9, Issue 1 https://doi.org/10.1038/s41524-023-01157-7	journal	October 2023
Thermal transport in warm dense matter revealed by refraction-enhanced x-ray radiography with a deep-neural-network analysis Jiang, S.; Landen, O. L.; Whitley, H. D. Communications Physics, Vol. 6, Issue 1 https://doi.org/10.1038/s42005-023-01190-4	journal	May 2023
Molecular dynamics evaluation of self-diffusion in Yukawa systems Ohta, H.; Hamaguchi, S. Physics of Plasmas, Vol. 7, Issue 11 https://doi.org/10.1063/1.1316084	journal	November 2000
Shear viscosity of strongly coupled Yukawa systems Saigo, T.; Hamaguchi, S. Physics of Plasmas, Vol. 9, Issue 4 https://doi.org/10.1063/1.1459708	journal	April 2002
Transport Coefficients Determined Using the Shielded Coulomb Potential Liboff, Richard L. Physics of Fluids, Vol. 2, Issue 1 https://doi.org/10.1063/1.1724389	journal	January 1959
Prescription for the design and selection of density functional approximations: More constraint satisfaction with fewer fits Perdew, John P.; Ruzsinszky, Adrienn; Tao, Jianmin The Journal of Chemical Physics, Vol. 123, Issue 6 https://doi.org/10.1063/1.1904565	journal	August 2005
Equation of state, transport coefficients, and stopping power of dense plasmas from the average-atom model self-consistent approach for astrophysical and laboratory plasmas Faussurier, Gérald; Blancard, Christophe; Cossé, Philippe Physics of Plasmas, Vol. 17, Issue 5 https://doi.org/10.1063/1.3420276	journal	May 2010
High-energy-density physics Drake, R. Paul Physics Today, Vol. 63, Issue 6 https://doi.org/10.1063/1.3455249	journal	June 2010
A database for equations of state and resistivities measurements in the warm dense matter regime Clérouin, J.; Noiret, P.; Blottiau, P. Physics of Plasmas, Vol. 19, Issue 8 https://doi.org/10.1063/1.4742317	journal	August 2012
Magnetically launched flyer plate technique for probing electrical conductivity of compressed copper Cochrane, K. R.; Lemke, R. W.; Riford, Z. Journal of Applied Physics, Vol. 119, Issue 10 https://doi.org/10.1063/1.4943417	journal	March 2016
First-principles investigations on ionization and thermal conductivity of polystyrene for inertial confinement fusion applications Hu, S. X.; Collins, L. A.; Goncharov, V. N. Physics of Plasmas, Vol. 23, Issue 4 https://doi.org/10.1063/1.4945753	journal	April 2016
Mean force kinetic theory: A convergent kinetic theory for weakly and strongly coupled plasmas Baalrud, Scott D.; Daligault, Jérôme Physics of Plasmas, Vol. 26, Issue 8 https://doi.org/10.1063/1.5095655	journal	August 2019
ABINIT: Overview and focus on selected capabilities Romero, Aldo H.; Allan, Douglas C.; Amadon, Bernard The Journal of Chemical Physics, Vol. 152, Issue 12 https://doi.org/10.1063/1.5144261	journal	March 2020
An electron conductivity model for dense plasmas Lee, Y. T.; More, R. M. Physics of Fluids, Vol. 27, Issue 5 https://doi.org/10.1063/1.864744	journal	January 1984
Friedel sum rule at finite temperature in hot dense plasmas Faussurier, Gérald; Blancard, Christophe Physics of Plasmas, Vol. 28, Issue 4 https://doi.org/10.1063/5.0022605	journal	April 2021
Determining the electrical conductivity of metals using the 2 MA Thor pulsed power driver Porwitzky, Andrew; Cochrane, Kyle R.; Stoltzfus, Brian Review of Scientific Instruments, Vol. 92, Issue 5 https://doi.org/10.1063/5.0037870	journal	May 2021
Efficacy of the radial pair potential approximation for molecular dynamics simulations of dense plasmas Stanek, Lucas J.; Clay, Raymond C.; Dharma-wardana, M. W. C. Physics of Plasmas, Vol. 28, Issue 3 https://doi.org/10.1063/5.0040062	journal	March 2021
Analytic models for interdiffusion in dense plasma mixtures Stanek, Lucas J.; Murillo, Michael S. Physics of Plasmas, Vol. 28, Issue 7 https://doi.org/10.1063/5.0047961	journal	July 2021
Efficient model for electronic transport in high energy-density matter Stanton, Liam G.; Murillo, Michael S. Physics of Plasmas, Vol. 28, Issue 8 https://doi.org/10.1063/5.0048162	journal	August 2021
Improving dynamic collision frequencies: Impacts on dynamic structure factors and stopping powers in warm dense matter Hentschel, Thomas W.; Kononov, Alina; Olmstead, Alexandra Physics of Plasmas, Vol. 30, Issue 6 https://doi.org/10.1063/5.0143738	journal	June 2023
Kohn–Sham accuracy from orbital-free density functional theory via Δ-machine learning Kumar, Shashikant; Jing, Xin; Pask, John E. The Journal of Chemical Physics, Vol. 159, Issue 24 https://doi.org/10.1063/5.0180541	journal	December 2023
Electrical conductivity of hydrogen plasmas: Low-density benchmarks and virial expansion including e–e collisions Röpke, G. Physics of Plasmas, Vol. 31, Issue 4 https://doi.org/10.1063/5.0197967	journal	April 2024
A review on charged-particle transport modeling for laser direct-drive fusion Hu, S. X.; Nichols, K. A.; Shaffer, N. R. Physics of Plasmas, Vol. 31, Issue 4 https://doi.org/10.1063/5.0197969	journal	April 2024
Transport coefficients of warm dense matter from Kohn-Sham density functional theory Melton, Cody A.; Clay, Raymond C.; Cochrane, Kyle R. Physics of Plasmas, Vol. 31, Issue 4 https://doi.org/10.1063/5.0198005	journal	April 2024
Reproducibility of real-time time-dependent density functional theory calculations of electronic stopping power in warm dense matter Kononov, Alina; White, Alexander J.; Nichols, Katarina A. Physics of Plasmas, Vol. 31, Issue 4 https://doi.org/10.1063/5.0198008	journal	April 2024
On-the-fly machine learned force fields for the study of warm dense matter: Application to diffusion and viscosity of CH Kumar, Shashikant; Jing, Xin; Pask, John E. Physics of Plasmas, Vol. 31, Issue 4 https://doi.org/10.1063/5.0204229	journal	April 2024
A theory of the electrical properties of liquid metals. I: The monovalent metals Ziman, J. M. Philosophical Magazine, Vol. 6, Issue 68 https://doi.org/10.1080/14786436108243361	journal	August 1961
The Boltzmann Equation in the Theory of Electrical Conduction in Metals Greenwood, D. A. Proceedings of the Physical Society, Vol. 71, Issue 4 https://doi.org/10.1088/0370-1328/71/4/306	journal	April 1958
The Law of Wiedemann and Franz Chester, G. V.; Thellung, A. Proceedings of the Physical Society, Vol. 77, Issue 5 https://doi.org/10.1088/0370-1328/77/5/309	journal	May 1961
Mixed stochastic-deterministic time-dependent density functional theory: application to stopping power of warm dense carbon White, Alexander J.; Collins, Lee A.; Nichols, Katarina Journal of Physics: Condensed Matter, Vol. 34, Issue 17 https://doi.org/10.1088/1361-648X/ac4f1a	journal	February 2022
Dynamical equations and transport coefficients for the metals at high pulse electromagnetic fields Volkov, N. B.; Chingina, E. A.; Yalovets, A. P. Journal of Physics: Conference Series, Vol. 774 https://doi.org/10.1088/1742-6596/774/1/012147	journal	November 2016
Assessment of localized and randomized algorithms for electronic structure Moussa, Jonathan E.; Baczewski, Andrew D. Electronic Structure, Vol. 1, Issue 3 https://doi.org/10.1088/2516-1075/ab2022	journal	July 2019
Disentangling the effects of non-adiabatic interactions upon ion self-diffusion within warm dense hydrogen Angermeier, William A.; Scheiner, Brett S.; Shaffer, Nathaniel R. Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, Vol. 381, Issue 2253 https://doi.org/10.1098/rsta.2023.0034	journal	July 2023
Reciprocal Relations in Irreversible Processes. I. Onsager, Lars Physical Review, Vol. 37, Issue 4 https://doi.org/10.1103/PhysRev.37.405	journal	February 1931
Density-functional theory of hydrogen plasmas Dharma-wardana, M. W. C.; Perrot, François Physical Review A, Vol. 26, Issue 4 https://doi.org/10.1103/PhysRevA.26.2096	journal	October 1982
Thermal hybrid exchange-correlation density functional for improving the description of warm dense matter Mihaylov, D. I.; Karasiev, V. V.; Hu, S. X. Physical Review B, Vol. 101, Issue 24 https://doi.org/10.1103/PhysRevB.101.245141	journal	June 2020
Meta-GGA exchange-correlation free energy density functional to increase the accuracy of warm dense matter simulations Karasiev, Valentin V.; Mihaylov, D. I.; Hu, S. X. Physical Review B, Vol. 105, Issue 8 https://doi.org/10.1103/PhysRevB.105.L081109	journal	February 2022
Electrical conductivity of iron in Earth's core from microscopic Ohm's law Ramakrishna, Kushal; Lokamani, Mani; Baczewski, Andrew Physical Review B, Vol. 107, Issue 11 https://doi.org/10.1103/PhysRevB.107.115131	journal	March 2023
Self-consistent field model for condensed matter Liberman, David A. Physical Review B, Vol. 20, Issue 12 https://doi.org/10.1103/PhysRevB.20.4981	journal	December 1979
Self-interaction correction to density-functional approximations for many-electron systems Perdew, J. P.; Zunger, Alex Physical Review B, Vol. 23, Issue 10, p. 5048-5079 https://doi.org/10.1103/PhysRevB.23.5048	journal	May 1981
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Kresse, G.; Furthmüller, J. Physical Review B, Vol. 54, Issue 16, p. 11169-11186 https://doi.org/10.1103/PhysRevB.54.11169	journal	October 1996
From ultrasoft pseudopotentials to the projector augmented-wave method Kresse, G.; Joubert, D. Physical Review B, Vol. 59, Issue 3, p. 1758-1775 https://doi.org/10.1103/PhysRevB.59.1758	journal	January 1999
Electronic transport coefficients from ab initio simulations and application to dense liquid hydrogen Holst, Bastian; French, Martin; Redmer, Ronald Physical Review B, Vol. 83, Issue 23 https://doi.org/10.1103/PhysRevB.83.235120	journal	June 2011
Accurate atomistic first-principles calculations of electronic stopping Schleife, André; Kanai, Yosuke; Correa, Alfredo A. Physical Review B, Vol. 91, Issue 1 https://doi.org/10.1103/PhysRevB.91.014306	journal	January 2015
Stochastic density functional theory at finite temperatures Cytter, Yael; Rabani, Eran; Neuhauser, Daniel Physical Review B, Vol. 97, Issue 11 https://doi.org/10.1103/PhysRevB.97.115207	journal	March 2018
Time-dependent orbital-free density functional theory for electronic stopping power: Comparison to the Mermin-Kohn-Sham theory at high temperatures White, Alexander J.; Certik, Ondrej; Ding, Y. H. Physical Review B, Vol. 98, Issue 14 https://doi.org/10.1103/PhysRevB.98.144302	journal	October 2018
Theory of the electron-ion temperature relaxation rate spanning the hot solid metals and plasma phases Daligault, Jérôme; Simoni, Jacopo Physical Review E, Vol. 100, Issue 4 https://doi.org/10.1103/PhysRevE.100.043201	journal	October 2019
Correlations between conduction electrons in dense plasmas Shaffer, Nathaniel R.; Starrett, Charles E. Physical Review E, Vol. 101, Issue 1 https://doi.org/10.1103/PhysRevE.101.013208	journal	January 2020
Electron-ion coupling factor for temperature relaxation in dense plasmas Faussurier, Gérald Physical Review E, Vol. 101, Issue 2 https://doi.org/10.1103/PhysRevE.101.023206	journal	February 2020
Model of electron transport in dense plasmas spanning temperature regimes Shaffer, Nathaniel R.; Starrett, Charles E. Physical Review E, Vol. 101, Issue 5 https://doi.org/10.1103/PhysRevE.101.053204	journal	May 2020
Modeling of short-pulse laser-metal interactions in the warm dense matter regime using the two-temperature model Petrov, G. M.; Davidson, A.; Gordon, D. Physical Review E, Vol. 103, Issue 3 https://doi.org/10.1103/PhysRevE.103.033204	journal	March 2021
Virial expansion of the electrical conductivity of hydrogen plasmas Röpke, G.; Schörner, M.; Redmer, R. Physical Review E, Vol. 104, Issue 4 https://doi.org/10.1103/PhysRevE.104.045204	journal	October 2021
Multifidelity regression of sparse plasma transport data available in disparate physical regimes Stanek, Lucas J.; Bopardikar, Shaunak D.; Murillo, Michael S. Physical Review E, Vol. 104, Issue 6 https://doi.org/10.1103/PhysRevE.104.065303	journal	December 2021
Electronic transport coefficients from density functional theory across the plasma plane French, Martin; Röpke, Gerd; Schörner, Maximilian Physical Review E, Vol. 105, Issue 6 https://doi.org/10.1103/PhysRevE.105.065204	journal	June 2022
Yukawa-Friedel-tail pair potentials for warm dense matter applications Dharma-wardana, M. W. C.; Stanek, Lucas J.; Murillo, Michael S. Physical Review E, Vol. 106, Issue 6 https://doi.org/10.1103/PhysRevE.106.065208	journal	December 2022
Time-dependent density-functional-theory calculations of the nonlocal electron stopping range for inertial confinement fusion applications Nichols, K. A.; Hu, S. X.; White, A. J. Physical Review E, Vol. 108, Issue 3 https://doi.org/10.1103/PhysRevE.108.035206	journal	September 2023
Stochastic and mixed density functional theory within the projector augmented wave formalism for simulation of warm dense matter Sharma, Vidushi; Collins, Lee A.; White, Alexander J. Physical Review E, Vol. 108, Issue 2 https://doi.org/10.1103/PhysRevE.108.L023201	journal	August 2023
Viscosity estimates for strongly coupled Yukawa systems Murillo, M. S. Physical Review E, Vol. 62, Issue 3 https://doi.org/10.1103/PhysRevE.62.4115	journal	September 2000
Nonlocal thermodynamic equilibrium self-consistent average-atom model for plasma physics Faussurier, G.; Blancard, C.; Berthier, E. Physical Review E, Vol. 63, Issue 2 https://doi.org/10.1103/PhysRevE.63.026401	journal	January 2001
Thermal conductivity of strongly coupled Yukawa liquids Donkó, Z.; Hartmann, P. Physical Review E, Vol. 69, Issue 1 https://doi.org/10.1103/PhysRevE.69.016405	journal	January 2004
Temperature determination using K α spectra from M -shell Ti ions Hansen, S. B.; Faenov, A. Ya.; Pikuz, T. A. Physical Review E, Vol. 72, Issue 3 https://doi.org/10.1103/PhysRevE.72.036408	journal	September 2005
Fully variational average atom model with ion-ion correlations Starrett, C. E.; Saumon, D. Physical Review E, Vol. 85, Issue 2 https://doi.org/10.1103/PhysRevE.85.026403	journal	February 2012
Plastic ablator and hydrodynamic instabilities: A first-principles set of microscopic coefficients Lambert, Flavien; Recoules, Vanina Physical Review E, Vol. 86, Issue 2 https://doi.org/10.1103/PhysRevE.86.026405	journal	August 2012
Partial ionization in dense plasmas: Comparisons among average-atom density functional models Murillo, Michael S.; Weisheit, Jon; Hansen, Stephanie B. Physical Review E, Vol. 87, Issue 6 https://doi.org/10.1103/PhysRevE.87.063113	journal	June 2013
First-principles thermal conductivity of warm-dense deuterium plasmas for inertial confinement fusion applications Hu, S. X.; Collins, L. A.; Boehly, T. R. Physical Review E, Vol. 89, Issue 4 https://doi.org/10.1103/PhysRevE.89.043105	journal	April 2014
Resistivity saturation in warm dense matter Faussurier, Gérald; Blancard, Christophe Physical Review E, Vol. 91, Issue 1 https://doi.org/10.1103/PhysRevE.91.013105	journal	January 2015
Ionic transport in high-energy-density matter Stanton, Liam G.; Murillo, Michael S. Physical Review E, Vol. 93, Issue 4 https://doi.org/10.1103/PhysRevE.93.043203	journal	April 2016
Effective Potential Theory for Transport Coefficients across Coupling Regimes Baalrud, Scott D.; Daligault, Jérôme Physical Review Letters, Vol. 110, Issue 23 https://doi.org/10.1103/PhysRevLett.110.235001	journal	June 2013
Accurate Homogeneous Electron Gas Exchange-Correlation Free Energy for Local Spin-Density Calculations Karasiev, Valentin V.; Sjostrom, Travis; Dufty, James Physical Review Letters, Vol. 112, Issue 7 https://doi.org/10.1103/PhysRevLett.112.076403	journal	February 2014
Free-Electron X-Ray Laser Measurements of Collisional-Damped Plasmons in Isochorically Heated Warm Dense Matter Sperling, P.; Gamboa, E. J.; Lee, H. J. Physical Review Letters, Vol. 115, Issue 11 https://doi.org/10.1103/PhysRevLett.115.115001	journal	September 2015
Ionic Transport Coefficients of Dense Plasmas without Molecular Dynamics Daligault, Jérôme; Baalrud, Scott D.; Starrett, Charles E. Physical Review Letters, Vol. 116, Issue 7 https://doi.org/10.1103/PhysRevLett.116.075002	journal	February 2016
X-ray Thomson Scattering in Warm Dense Matter without the Chihara Decomposition Baczewski, A. D.; Shulenburger, L.; Desjarlais, M. P. Physical Review Letters, Vol. 116, Issue 11 https://doi.org/10.1103/PhysRevLett.116.115004	journal	March 2016
Ab Initio Studies on the Stopping Power of Warm Dense Matter with Time-Dependent Orbital-Free Density Functional Theory Ding, Y. H.; White, A. J.; Hu, S. X. Physical Review Letters, Vol. 121, Issue 14 https://doi.org/10.1103/PhysRevLett.121.145001	journal	October 2018
First-Principles Determination of Electron-Ion Couplings in the Warm Dense Matter Regime Simoni, Jacopo; Daligault, Jérôme Physical Review Letters, Vol. 122, Issue 20 https://doi.org/10.1103/PhysRevLett.122.205001	journal	May 2019
Fast and Universal Kohn-Sham Density Functional Theory Algorithm for Warm Dense Matter to Hot Dense Plasma White, A. J.; Collins, L. A. Physical Review Letters, Vol. 125, Issue 5 https://doi.org/10.1103/PhysRevLett.125.055002	journal	July 2020
Resistivity of a Simple Metal from Room Temperature to 10 6 K Milchberg, H. M.; Freeman, R. R.; Davey, S. C. Physical Review Letters, Vol. 61, Issue 20 https://doi.org/10.1103/PhysRevLett.61.2364	journal	November 1988
Generalized Gradient Approximation Made Simple Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868 https://doi.org/10.1103/PhysRevLett.77.3865	journal	October 1996
Single-State Measurement of Electrical Conductivity of Warm Dense Gold Widmann, K.; Ao, T.; Foord, M. E. Physical Review Letters, Vol. 92, Issue 12 https://doi.org/10.1103/PhysRevLett.92.125002	journal	March 2004
Heat Transfer Mechanisms During Short-Pulse Laser Heating of Metals Qiu, T. Q.; Tien, C. L. Journal of Heat Transfer, Vol. 115, Issue 4 https://doi.org/10.1115/1.2911377	journal	November 1993
Negative differential conductivity in liquid aluminum from real-time quantum simulations Andrade, Xavier; Hamel, Sébastien; Correa, Alfredo A. The European Physical Journal B, Vol. 91, Issue 10 https://doi.org/10.1140/epjb/e2018-90291-5	journal	October 2018
On the Interaction of Elementary Particles. I Yukawa, Hideki Proceedings of the Physico-Mathematical Society of Japan. 3rd Series, Vol. 17, p. 48-57 https://doi.org/10.11429/ppmsj1919.17.0_48	journal	January 1935
Statistical-Mechanical Theory of Irreversible Processes. I. General Theory and Simple Applications to Magnetic and Conduction Problems Kubo, Ryogo Journal of the Physical Society of Japan, Vol. 12, Issue 6 https://doi.org/10.1143/JPSJ.12.570	journal	June 1957
Numerical implementation of time-dependent density functional theory for extended systems in extreme environments Baczewski, Andrew David; Shulenburger, Luke; Desjarlais, Michael Paul https://doi.org/10.2172/1204090	report	February 2014
Data-driven electrical conductivities of dense plasmas Murillo, Michael S. Frontiers in Physics, Vol. 10 https://doi.org/10.3389/fphy.2022.867990	journal	November 2022
Thermodynamic Functions of a Metal Exposed to High Energy Densities in Compressed and Expanded States Volkov, Nikolay B.; Lipchak, Alexander I. Condensed Matter, Vol. 7, Issue 4 https://doi.org/10.3390/condmat7040061	journal	October 2022
The Transport and Optical Characteristics of a Metal Exposed to High-Density Energy Fluxes in Compressed and Expanded States of Matter Volkov, Nikolay B.; Lipchak, Alexander I. Condensed Matter, Vol. 8, Issue 3 https://doi.org/10.3390/condmat8030070	journal	August 2023

Similar Records

Review of the first charged-particle transport coefficient comparison workshop

Journal Article · 2020 · High Energy Density Physics · OSTI ID:1772031

Grabowski, P. E.; Hansen, S. B.; Murillo, M. S.; +42 more

Charged particle transport coefficient challenges in high energy density plasmas

Journal Article · 2024 · Physics of Plasmas · OSTI ID:2567650

Haines, Brian M.

Charged-particle transport in high energy density plasmas

Journal Article · 2024 · Physics of Plasmas · OSTI ID:2504055

Hansen, Stephanie B.; Stanek, Lucas J.; Haines, Brian M.; +5 more

Related Subjects

71 CLASSICAL AND QUANTUM MECHANICS
GENERAL PHYSICS
Kohn-Sham density functional theory
electrical conductivity
electronic transport
molecular dynamics
plasma transport properties
stopping power
thermal conductivity
thermal diffusivity
time dependent density functional theory
viscosity

Title: Review of the second charged-particle transport coefficient code comparison workshop

Citation Formats

References (107)

Similar Records

Related Subjects