3 件のレコードが見つかりました。
Near-surface defects break symmetry in water adsorption on CeO2−x(111)
- 論文
- 著者
-
Oscar Custance
;
Manuel González Lastre
;
Kyungmin Kim
;
Estefanía Fernández-Villanueva
;
Pablo Pou
;
Masayuki Abe
;
Hossein Sepehri-Amin
;
Shigeki Kawai
;
M. Verónica Ganduglia-Pirovano
;
Ruben Perez
- キーワード
- scanning probe microscopy, cerium dioxide, water, surface, thin films, density functional theory
- 刊行年月日
- 2026-01-23
- 更新時刻
- 2026-02-08 08:30:20 +0900
Thermoelectric properties of marcasite-type compounds MSb2 (M = Ta, Nb): a combined experimental and computational study
- 論文
- 著者
-
Shamim Sk
;
Naoki Sato
;
Takao Mori
- キーワード
- Thermoelectric properties, density functional theory, electronic structure, electron and hole pockets, semi-classical Boltzmann theory, power factor
- 刊行年月日
- 2025-03-31
- 更新時刻
- 2026-02-18 12:30:04 +0900
Unveiling the Intermolecular Interactions between Drug 5-Fluorouracil and Watson–Crick/Hoogsteen Base Pairs: A Computational Analysis
- 論文
- 著者
-
Natarajan Sathiyamoorthy Venkataramanan
;
Ambigapathy Suvitha
;
Ryoji Sahara
- キーワード
- density functional theory, Watson−Crick/Hoogsteen Base Pairs, 5-fluorouracil
- 刊行年月日
- 2024-06-11
- 更新時刻
- 2024-06-25 12:30:13 +0900