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A parallel implementation of the analytic nuclear gradient for time-dependent density functional theory within the Tamm–Dancoff approximation

✍ Scribed by Liu, Fenglai; Gan, Zhengting; Shao, Yihan; Hsu, Chao-Ping; Dreuw, Andreas; Head-Gordon, Martin; Miller, Benjamin T.; Brooks, Bernard R.; Yu, Jian-Guo; Furlani, Thomas R.; Kong, Jing

Book ID: 121790621
Publisher: Taylor and Francis Group
Year: 2010
Tongue: English
Weight: 156 KB
Volume: 108
Category: Article
ISSN: 0026-8976
DOI: 10.1080/00268976.2010.526642

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