Numerical atomic basis orbitals from H to Kr
- ジャーナル論文
- 著者
-
;T. Ozaki (author) (この著者で検索)H. Kino (author) (この著者で検索)National Institute for Materials Science
- キーワード
- OpenMX, first-principles calculation, DFT, LCAO, numerical atomic basis, benchmark, molecules, bulks
- 刊行年月日
- 2004-05-28
- 更新時刻
- 2024-01-05 22:11:39 +0900
Assessing Ni2(dobpdc) Anchoring for Mitigating Lithium Polysulfide Dissolution in Lithium–Sulfur Batteries
- ジャーナル論文
- 著者
-
Kuan-Yu Lin (author) (この著者で検索)
https://orcid.org/0000-0002-2426-5543
(unauthenticated)
;
;Mei-Ru Lai (author) (この著者で検索);Minoru Otani (author) (この著者で検索)Tsuyoshi Miyazaki (author) (この著者で検索)National Institute for Materials Science
;
Jyh-Chiang Jiang (author) (この著者で検索) - キーワード
- Li-S battery, DFT, 3D-RISM, MOF
- 刊行年月日
- 2024-10-03
- 更新時刻
- 2024-11-21 16:30:34 +0900
Adsorption of Cs Ions in Hydroxy-Al Interlayered Clay Minerals and the Aging Mechanism
- ジャーナル論文
- 著者
-
Hiroshi Sakuma (author) (この著者で検索)National Institute for Materials Science
;
Kenji Tamura (author) (この著者で検索)National Institute for Materials Science
;
Shigeru Suehara (author) (この著者で検索)National Institute for Materials Science
;
Kenjiro Hashi (author) (この著者で検索)National Institute for Materials Science
- キーワード
- Cesium, phlogopite, vermiculite, NMR, molecular dynamics, DFT
- 刊行年月日
- 2026-03-03
- 更新時刻
- 2026-03-05 16:30:12 +0900
Unveiling dendrite-suppressing potential of alkali metal-based alloys in lithium metal batteries
- ジャーナル論文
- 著者
-
;Kuan-Yu Lin (author) (この著者で検索);Rui-Tong Kuo (author) (この著者で検索)Tsuyoshi Miyazaki (author) (この著者で検索)National Institute for Materials Science
;
;Bing Joe Hwang (author) (この著者で検索)Jyh-Chiang Jiang (author) (この著者で検索)
- キーワード
- Li metal battery, DFT, solid electrolyte interface, MD
- 刊行年月日
- 2024-04-13
- 更新時刻
- 2024-08-20 10:48:14 +0900