Presentations

Accelerating Extreme Condition System Simulations

S.B. Trickey

PDF     DOE FY 2020 Highlight, 11 Aug. 2020

Analysis of over-magnetization of elemental transition metal solids from the SCAN and related density functionals

Daniel Mejía-Rodríguez

PDF     Amer. Phys. Soc. March 2020 Meeting (cancelled) talk A58.004

Local Pressures for Strongly Inhomogeneous States

J.W. Dufty

PDF     Amer. Phys. Soc. March 2020 Meeting (cancelled) talk X02.007

Nuclear Quantum Effects in Two-temperature Hydrogen via Orbital-free DFT Path Integral MD

S.B. Trickey

PDF     Amer. Phys. Soc. March 2020 Meeting (cancelled) talk P03.002

Less is More - or - Back to Kohn-Sham

S.B. Trickey

PDF     Current Topics in Theoretical Chemistry, 01-05 July 2019, Quito, Ecuador

Thermodynamics for Non-uniform Systems and DFT

J.W. Dufty

PDF     CECAM Workshop "Fundamentals of Density Functional Theory for T> 0: Quantum meets Classical", 20-23 May 2019, Lausanne Switzerland

Essentials of Many-Fermion DFT and Their Relationship [or Lack Thereof] to Classical DFT

S.B. Trickey

PDF     CECAM Workshop "Fundamentals of Density Functional Theory for T> 0: Quantum meets Classical", 20-23 May 2019, Lausanne Switzerland

Development of Free Energy Density Functional Theory: Predictive Power of First Principles Approximations for Warm Dense Matter

Kai Luo

PDF     4th Internat. Conference on High Energy Density Physics, 21-25 Oct. 2018, Ningbo China

Simplification of meta-GGA Exchange-Correlation Functionals

S.B. Trickey

PDF     XVII Internat. Materials Research Congress, 21 August 2018, Cancún México

Finite-temperature Exchange-Correlation Functionals: Developments and Implications

S.B. Trickey, V.V. Karasiev, L. Calderín, and J.W. Dufty

PDF     Invited presentation, WDM 2017 Workshop, 10 April 2017. Vancouver BC

Generalized Gradient Approximation for Exchange-Correlation Free Energy

V.V. Karasiev, J.W. Dufty, and S.B. Trickey

PDF     Paper L26:04, APS March meeting, 15 March 2017. New Orleans LA

Kubo-Greenwood Electric Conductivity Tensor: Essentials and Open-source Implementation

L. Calderín, V.V. Karasiev, J.W. Dufty, and S.B. Trickey

PDF     Paper K2:05, APS March meeting, 15 March 2017. New Orleans LA

Tunable Non-interacting Free-energy Functionals: Development and Applications to Low-density Aluminum

S.B. Trickey and V.V. Karasiev

PDF     Paper K2:06, APS March meeting, 15 March 2017. New Orleans LA

Equivalence of Functionals for the Electron Gas and Jellium at Finite Temperature

James W. Dufty

PDF     Paper C8:13, APS March meeting, 13 March 2017. New Orleans LA

Restricted Path-Integral Molecular Dynamics for Simulating the Correlated Electron Plasma in Warm Dense Matter

Vivek Kapila

PDF     Presented at the APS DPP Meeting Nov. 14-18, 2011, Salt Lake City UT

Temperature-Dependent Behavior of Confined Many-electron Systems in the Hartree-Fock Approximation

Travis Sjostrom

PDF     Presented at the APS DPP Meeting Nov. 14-18, 2011, Salt Lake City, UT

Finite-Temperature Orbital-free Density Functional Calculations for Warm Dense Lithium

Valentin Karasiev

PDF     (poster) Presented at the APS DPP Meeting Nov. 14-18, 2011, Salt Lake City, UT

Classical Representation of a Quantum System at Equilibrium

Sandipan Dutta

PDF     (poster) Presented at the APS DPP Meeting Nov. 14-18, 2011, Salt Lake City, UT

Temperature-Dependent Behavior of Confined Many-electron systems in the Hartree-Fock Approximation

Sam Trickey

PDF     Presented at the "First International Workshop on Studies of Confined Quantum Systems" held at Universidad Metropolitana Autonoma - Iztapalapa, Mexico City, 7-9 Sept. 2011

Classical Representation of a Quantum System at Equilibrium

Jim Dufty

PDF     Presented at the Strongly Coupled Coulomb Systems 2011 conference held in Budapest, Hungary July 24-29, 2011.

Recent advances in development of single-point orbital-free kinetic energy functionals

Valentin Karasiev

PDF     Presented at Pacifichem 2010 conference held in Honolulu, Hawaii Dec. 15-20, 2010.