Input and Output Data for "Quartic Anharmonicity of Rattlers and Its Effect on Lattice Thermal Conductivity of Clathrates from First Principles"
- データセット
- 著者
-
;Terumasa Tadano (author) (この著者で検索)Shinji Tsuneyuki (author) (この著者で検索)
- キーワード
- Clathrates, First-principles calculation, Phonon, Lattice thermal conductivity
- 刊行年月日
- 2018-03-07
- 更新時刻
- 2026-08-19 16:57:17 +0900
Input and Output Data for "Impact of Rattlers on Thermal Conductivity of a Thermoelectric Clathrate: A First-Principles Study"
- データセット
- 著者
-
;Terumasa Tadano (author) (この著者で検索);Yoshihiro Gohda (author) (この著者で検索)Shinji Tsuneyuki (author) (この著者で検索)
- キーワード
- Clathrates, First-principles calculation, Phonon, Lattice thermal conductivity
- 刊行年月日
- 2015-03-04
- 更新時刻
- 2026-08-18 15:46:45 +0900
Role of atypical temperature-responsive lattice thermal transport on the thermoelectric properties of antiperovskites Mg3XN (X = P, As, Sb, Bi)
- ジャーナル論文
- 著者
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;Jincheng Yue (author) (この著者で検索);Yanhui Liu (author) (この著者で検索);Wenling Ren (author) (この著者で検索);Shuyao Lin (author) (この著者で検索);Chen Shen (author) (この著者で検索);Harish Kumar Singh (author) (この著者で検索);Tian Cui (author) (この著者で検索)Terumasa Tadano (author) (この著者で検索)National Institute for Materials Science
;
Hongbin Zhang (author) (この著者で検索) - キーワード
- Antiperovskite, First-principles calculation, Four-phonon scattering, Self-consistent phonon theory, Thermoelectric properties, Anharmonicity
- 刊行年月日
- 2024-01-25
- 更新時刻
- 2026-01-24 12:30:21 +0900
Accurate screening of functional materials with machine-learning potential and transfer-learned regressions: Heusler alloy benchmark
- ジャーナル論文
- 著者
-
Enda Xiao (author) (この著者で検索)
https://orcid.org/0000-0002-4372-1575
(unauthenticated)
;
Terumasa Tadano (author) (この著者で検索)
- キーワード
- Heusler alloys, Machine-learning potential, Transfer learning, First-principles calculation, Curie temperature, Magnetic anisotropy energy
- 刊行年月日
- 2026-02-19
- 更新時刻
- 2026-03-30 13:06:06 +0900