Speed-up of Ab Initio Hybrid Monte Carlo and Ab Initio Path Integral Hybrid Monte Carlo Simulations by Using an Auxiliary Potential Energy Surface
Nakayama, Akira; Taketsugu, Tetsuya; Shiga, Motoyuki
- 期刊名称Chemistry Letters
- 作者Nakayama, Akira; Taketsugu, Tetsuya; Shiga, Motoyuki
- 卷第38卷
- 期第10期
- 印刷ISSN0366-7022
- 电子ISSN1348-0715
- 文件大小76.28KB
- 发表时间2009-10-05
- DOI10.1246/cl.2009.976
- 页码976-977