Theoretical search for characteristic atoms in supported gold nanoparticles: a large-scale DFT study
- ジャーナル論文
- 著者
-
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
Stable structures of (VGaVN) n defects in bulk GaN
- ジャーナル論文
- 著者
-
Hiroyuki Ishihara (author) (この著者で検索)
https://orcid.org/0009-0002-5824-430X
(unauthenticated)
;
Masato Oda (author) (この著者で検索)
https://orcid.org/0000-0002-8731-5122
(unauthenticated)
;
Tsuyoshi Miyazaki (author) (この著者で検索)
- キーワード
- GaN, First-principles calculations, Large-scale DFT, Vacancy, Defects
- 刊行年月日
- 2026-08-24
- 更新時刻
- 2026-08-26 10:56:41 +0900