activity
20202026
most citedFirst principles simulations of dense hydrogen

89 citations · 238 across the 13 of their papers we have counts for

collaborators
Showing 2025Show all

4 papers · 1 filter

physics.comp-ph2025

The noiseless limit and improved-prior limit of the maximum entropy method and their implications for the analytic continuation problem

Thomas Chuna, Nicholas Barnfield, Paul Hamann +3

Quantum Monte Carlo (QMC) methods are uniquely capable of providing exact simulations of quantum many-body systems. Unfortunately, the applications of a QMC simulation are limited…

physics.chem-ph2025

Taylor series perspective on ab initio path integral Monte Carlo simulations with Fermi-Dirac statistics

Tobias Dornheim, Alexander Benedix Robles, Paul Hamann +6

The fermion sign problem constitutes a fundamental computational bottleneck across a plethora of research fields in physics, quantum chemistry and related disciplines. Recently, it…

physics.chem-ph2025

Reweighting scheme for the calculation of grand-canonical expectation values in quantum Monte Carlo simulations with a fermion sign problem

Paul Hamann, Jan Vorberger, Tobias Dornheim

Ab initio path integral Monte Carlo (PIMC) simulations constitute the gold standard for the estimation of a broad range of equilibrium properties of a host of interacting quantum m…

physics.chem-ph2025

Re-weighting estimator for ab initio path integral Monte Carlo simulations of fictitious identical particles

Tobias Dornheim, Pontus Svensson, Paul Hamann +4

The fermion sign problem constitutes one of the most fundamental obstacles in quantum many-body theory. Recently, it has been suggested to circumvent the sign problem by carrying o…