activity
20022024
most citedSome improvements of the ART method for finding transition pathways on potential energy surfaces

119 citations · 791 across the 52 of their papers we have counts for

collaborators
Showing 2006Show all

2 papers · 1 filter

cond-mat.other2006★ 33 cited

An efficient sampling algorithm for Variational Monte Carlo

Anthony Scemama, Tony Lelièvre, Gabriel Stoltz +2

We propose a new algorithm for sampling the -body density in the Variational Monte Carlo (VMC) framework. This algorithm is based u…

quant-ph2006★ 117 cited

The Electronic Ground State Energy Problem: a New Reduced Density Matrix Approach

Eric Cances, Gabriel Stoltz, Mathieu Lewin

We present here a formulation of the electronic ground-state energy in terms of the second order reduced density matrix, using a duality argument. It is shown that the computation…