Fast evaluation of unbiased atomic forces in ab initio variational Monte Carlo via the Lagrangian technique

ジャーナル論文

著者

Kousuke Nakano (author) (この著者で検索)

https://orcid.org/0000-0001-7756-4355

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

Kousuke Nakano ;

Stefano Battaglia (author) (この著者で検索)

Stefano Battaglia ;

Jürg Hutter (author) (この著者で検索)

Jürg Hutter

キーワード

ab initio Quantum Monte Carlo

刊行年月日

2026-03-28

更新時刻

2026-04-02 10:26:04 +0900