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

Kousuke Nakano, Stefano Battaglia, Jürg Hutter, Stefano Battaglia, Jürg Hutter.

The Journal of Chemical Physics 164 [12] 124113. 2026.

https://doi.org/10.1063/5.0311160

Open Access AIP Publishing (Publisher) Materials Data Repository (MDR)

NIMS著者

中野晃佑

Materials Data Repository (MDR)上の本文・データセット

MDRavailable Fast evaluation of unbiased atomic forces in <i>ab initio</i> variational Monte Carlo via the Lagrangian technique

作成時刻: 2026-04-02 03:06:24 +0900 更新時刻: 2026-10-08 09:16:22 +0900

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