A scheme for rapid evaluation of the intermolecular three-body polarization effect in water clusters.

Li, Xiao-Lei; Li, Chao-Ming; Zhu, Jia-Yi; Zhou, Zhan; Hao, Qiang; Wang, Chang-Sheng

Li, Xiao-Lei; Li, Chao-Ming; Zhu, Jia-Yi; Zhou, Zhan; Hao, Qiang; Wang, Chang-Sheng.

Afiliación

Li XL; School of Chemistry and Chemical Engineering, Liaoning Normal University, Dalian, People's Republic of China.
Li CM; School of Chemistry and Chemical Engineering, Liaoning Normal University, Dalian, People's Republic of China.
Zhu JY; School of Chemistry and Chemical Engineering, Liaoning Normal University, Dalian, People's Republic of China.
Zhou Z; School of Chemistry and Chemical Engineering, Liaoning Normal University, Dalian, People's Republic of China.
Hao Q; School of Chemistry and Chemical Engineering, Liaoning Normal University, Dalian, People's Republic of China.
Wang CS; School of Chemistry and Chemical Engineering, Liaoning Normal University, Dalian, People's Republic of China.

J Comput Chem ; 44(5): 677-686, 2023 Feb 15.

Article en En | MEDLINE | ID: mdl-36408852

Asunto(s)

Agua; Termodinámica; Simulación por Computador

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Asunto principal: Agua Tipo de estudio: Prognostic_studies Idioma: En Revista: J Comput Chem Asunto de la revista: QUIMICA Año: 2023 Tipo del documento: Article Pais de publicación: Estados Unidos

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