Theoretical search for characteristic atoms in supported gold nanoparticles: a large-scale DFT study
- ジャーナル論文
- 著者
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Shengzhou Li (author) (この著者で検索)National Institute for Materials Science
;
Tsuyoshi Miyazaki (author) (この著者で検索)National Institute for Materials Science
;
Ayako Nakata (author) (この著者で検索)National Institute for Materials Science
- キーワード
- Large-scale DFT, gold nanoparticle, supported nanoparticle, statistic analysis, density of states, principal component analysis, first-principles calculation
- 刊行年月日
- 2024-06-21
- 更新時刻
- 2024-08-31 08:30:29 +0900
Phonon Olympics: Phonon property and lattice thermal conductivity benchmarking from open-source packages
- ジャーナル論文
- 著者
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Alan J. H. McGaughey (author) (この著者で検索)
https://orcid.org/0000-0002-0118-6893
(unauthenticated)
;
Lucas Lindsay (author) (この著者で検索)
https://orcid.org/0000-0001-9645-7993
(unauthenticated)
;
Hua Bao (author) (この著者で検索)
https://orcid.org/0000-0002-3524-2056
(unauthenticated)
;
Tomu Hamakawa (author) (この著者で検索)
https://orcid.org/0009-0009-5960-2464
(unauthenticated)
;
Rinkle Juneja (author) (この著者で検索)
https://orcid.org/0000-0001-6372-1524
(unauthenticated)
;
Shouhang Li (author) (この著者で検索)
https://orcid.org/0000-0001-6287-8394
(unauthenticated)
;
Wu Li (author) (この著者で検索)
https://orcid.org/0000-0003-3854-4268
(unauthenticated)
;
;Ryota Masuki (author) (この著者で検索)Fanchen Meng (author) (この著者で検索)
https://orcid.org/0000-0001-9869-9005
(unauthenticated)
;
;Han Meng (author) (この著者で検索)Tribhuwan Pandey (author) (この著者で検索)
https://orcid.org/0000-0002-0373-7716
(unauthenticated)
;
Cheng Shao (author) (この著者で検索)
https://orcid.org/0000-0002-4382-2608
(unauthenticated)
;
Junichiro Shiomi (author) (この著者で検索)
https://orcid.org/0000-0002-3552-4555
(unauthenticated)
;
Terumasa Tadano (author) (この著者で検索)
;
Atsushi Togo (author) (この著者で検索)
;
Ao Wang (author) (この著者で検索)
https://orcid.org/0000-0002-3876-5987
(unauthenticated)
;
Xinyu Zhang (author) (この著者で検索)
https://orcid.org/0000-0001-7666-9892
(unauthenticated)
- キーワード
- phonon, first-principles calculation, lattice thermal conductivity
- 刊行年月日
- 2025-10-07
- 更新時刻
- 2025-11-13 12:30:10 +0900