Multicomponent density functional theory: Including the density gradient in the electron-proton correlation functional for hydrogen and deuterium

Multicomponent density functional theory: Including the density gradient in the electron-proton correlation functional for hydrogen and deuterium
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多组分密度泛函理论:包括氢和氘的电子-质子相关泛函中的密度梯度

DOI:
10.1063/1.5119124
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发表时间:
2019
期刊:
The Journal of Chemical Physics
影响因子:
--
通讯作者:
Hammes-Schiffer, Sharon
Hammes-Schiffer, Sharon
中科院分区:
--
文献类型:
--
作者:
Tao, Zhen;Yang, Yang;Hammes-Schiffer, Sharon

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