Enabling simulation at the fifth rung of DFT: Large scale RPA calculations with excellent time to solution

出版年份 2015 全文链接

标题

作者

关键词

Random phase approximation, RPA, Density functional theory, DFT, Monte Carlo, CP2K

出版物

Volume 187, Issue -, Pages 120-129

出版商

Elsevier BV

发表日期

2014-11-05

DOI

10.1016/j.cpc.2014.10.021

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