3 records found.
Load-balanced diffusion Monte Carlo method with lattice regularization
- Journal article
- Creator
-
Kousuke Nakano (author) (Search by this author)National Institute for Materials Science
;
;Sandro Sorella (author) (Search by this author)Michele Casula (author) (Search by this author) - Keyword
- Quantum Monte Carlo, Variational Monte Carlo, Diffusion Monte Carlo, Diffusion Monte Carlo method with lattice regularization
- Date published
- 2025-11-21
- Updated at
- 2025-12-02 08:30:15 +0900
Basis Set Incompleteness Errors in Fixed-Node Diffusion Monte Carlo Calculations on Noncovalent Interactions
- Journal article
- Creator
-
Kousuke Nakano (author) (Search by this author)National Institute for Materials Science
;
;Benjamin X. Shi (author) (Search by this author);Dario Alfè (author) (Search by this author)Andrea Zen (author) (Search by this author)
- Keyword
- Quantum Monte Carlo, Diffusion Monte Carlo, Fixed-Node Error
- Date published
- 2025-05-13
- Updated at
- 2025-12-02 08:30:03 +0900
Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water–methane dimer
- Journal article
- Creator
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;Flaviano Della Pia (author) (Search by this author);Benjamin X. Shi (author) (Search by this author);Yasmine S. Al-Hamdani (author) (Search by this author);Dario Alfé (author) (Search by this author);Tyler A. Anderson (author) (Search by this author);Matteo Barborini (author) (Search by this author);Anouar Benali (author) (Search by this author);Michele Casula (author) (Search by this author);Neil D. Drummond (author) (Search by this author);Matúš Dubecký (author) (Search by this author);Claudia Filippi (author) (Search by this author);Paul R. C. Kent (author) (Search by this author);Jaron T. Krogel (author) (Search by this author);Pablo López Ríos (author) (Search by this author);Arne Lüchow (author) (Search by this author);Ye Luo (author) (Search by this author);Angelos Michaelides (author) (Search by this author);Lubos Mitas (author) (Search by this author)Kousuke Nakano (author) (Search by this author)National Institute for Materials Science
;
;Richard J. Needs (author) (Search by this author);Manolo C. Per (author) (Search by this author);Anthony Scemama (author) (Search by this author);Jil Schultze (author) (Search by this author);Ravindra Shinde (author) (Search by this author);Emiel Slootman (author) (Search by this author);Sandro Sorella (author) (Search by this author);Alexandre Tkatchenko (author) (Search by this author);Mike Towler (author) (Search by this author);C. J. Umrigar (author) (Search by this author);Lucas K. Wagner (author) (Search by this author);William A. Wheeler (author) (Search by this author);Haihan Zhou (author) (Search by this author)Andrea Zen (author) (Search by this author)
- Keyword
- Quantum Monte Carlo, Diffusion Monte Carlo
- Date published
- 2025-09-14
- Updated at
- 2025-12-02 08:30:07 +0900