ファイル種別: application/pdf キーワード: First-principles calculations

2 件のレコードが見つかりました。

1-s2.0-S0169433222035930-main.pdf
First-principles study of the reconstruction of MgM2O4 (M = Mn, Fe, Co) spinel surface
ジャーナル論文
著者
Tomoaki Kaneko (author) (この著者で検索)
National Institute for Materials Science (NIMS) Research and Services Division of Materials Data and Integrated System (MaDIS)
ORCID ;
Yui Fujihara (author) (この著者で検索)
Tohoku university Institute of Multidisciplinary Research for Advanced Materials
ORCID ;
Hiroaki Kobayashi (author) (この著者で検索)
Tohoku university Institute of Multidisciplinary Research for Advanced Materials
ORCID ;
Keitaro Sodeyama (author) (この著者で検索)
National Institute for Materials Science (NIMS) Research and Services Division of Materials Data and Integrated System (MaDIS)
ORCID SAMURAI
キーワード
Mg-battery, Cathode, Spinel Surface, Surface reconstruction, First-principles calculations
刊行年月日
2022-12-17
更新時刻
2024-01-05 22:13:50 +0900

jpsj.93.123704.pdf
Stability of Correlated Insulating States in Molecular Conductors from First-Principles Calculation
ジャーナル論文
著者
Takao Tsumuraya (author) (この著者で検索)
ORCID ; ORCID SAMURAI ;
Hitoshi Seo (author) (この著者で検索)
キーワード
First-principles calculations, Density Functional Theory, Molecular Conductors, Strongly Correlated Systems
刊行年月日
2024-12-15
更新時刻
2024-11-21 16:30:38 +0900