368 citations · 7.1k across the 106 of their papers we have counts for
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Calculation of a Deuterium Double Shock Hugoniot from Ab initio Simulations
B. Militzer, D. M. Ceperley, J. D. Kress +3
We calculate the equation of state of dense deuterium with two ab initio simulations techniques, path integral Monte Carlo and density functional theory molecular dynamics, in the…
What do we know about wave function nodes?
D. Bressanini, D. M. Ceperley, P. J. Reynolds
Although quantum Monte Carlo is, in principal, an exact method for solving the Schroedinger equation, it is well-known that systems of Fermions still pose a challenge. Thus far all…
Path Integral Monte Carlo Simulation of the Low-Density Hydrogen Plasma
B. Militzer, D. M. Ceperley
Restricted path integral Monte Carlo simulations are used to calculate the equilibrium properties of hydrogen in the density and temperature range of $9.83 \times 10^{-4}\rm \leq ρ…
Twist-averaged Boundary Conditions in Continuum Quantum Monte Carlo
C. Lin, F. -H. Zong, D. M. Ceperley
We develop and test Quantum Monte Carlo algorithms which use a``twist'' or a phase in the wave function for fermions in periodic boundary conditions. For metallic systems, averagin…