分割統治型密度汎関数強束縛分子動力学(DC-DFTB-MD)法による表面反応シミュレーション : Pt(111)表面上のプロトン拡散 (特集 2018年日本表面真空学会学術講演会特集号(3))
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- Material Type
- 記事
- Author/Editor
- 中井 浩巳西村 好史Aditya Wibawa SaktiTanabat Mudchimo周 建斌
- Series Title
- Author Heading
- Alternative Title
- Surface Reaction Simulation based on Divide-and-Conquer Type Density Functional Tight-Binding Molecular Dynamics (DC-DFTB-MD) Method : Case for Proton Diffusion on Pt(111) Surface
- Periodical title
- 表面と真空 = Vacuum and surface science / 日本表面科学会, 日本真空学会 編
- No. or year of volume/issue
- 62(8):2019.8
- Volume
- 62
- Issue
- 8