All-electron calculation of nonadiabatic couplings from time-dependent density functional theory: Probing with the Hartree–Fock exact exchange | 研究者総覧SAMURAI - 物質・材料研究機構 (NIMS)

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All-electron calculation of nonadiabatic couplings from time-dependent density functional theory: Probing with the Hartree–Fock exact exchange

Chunping Hu, Osamu Sugino, Yoshitaka Tateyama.

The Journal of Chemical Physics 131 [11] 114101. 2009.

https://doi.org/10.1063/1.3226344

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作成時刻: 2016-05-24 15:51:53 +0900更新時刻: 2024-03-31 17:50:46 +0900

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