[Research Highlights Vol.21] Supercomputing in materials science: First-principles simulations of large molecules
- 雑誌
- コレクション
- Research Highlights
- 著者
-
International Center for Materials Nanoarchitectonics (WPI-MANA) (author) (この著者で検索)National Institute for Materials Science
- キーワード
- Density Functional Theory, First-principles calculations, Molecular Dynamics Simulations, Linear-scaling method or O(N) method, Computational Materials Science
- 刊行年月日
- 2015-03-27
- 更新時刻
- 2023-12-25 00:30:18 +0900