Electronic origin of the dependence of hydrogen bond strengths on nearest-neighbor and next-nearest-neighbor hydrogen bonds in polyhedral water clusters (H2O)n, n = 8, 20 and 24.

Iwata, Suehiro; Akase, Dai; Aida, Misako; Xantheas, Sotiris S

Iwata, Suehiro; Akase, Dai; Aida, Misako; Xantheas, Sotiris S.

Afiliação

Iwata S; Department of Chemistry, Faculty of Science and Technology, Keio University, Kohoku, Yokohama 223-8522, Japan. iwatasuehiro@gmail.com.
Akase D; Graduate School of Science, Hiroshima University, Higashi Hiroshima, 739-8526, Japan.
Aida M; Graduate School of Science, Hiroshima University, Higashi Hiroshima, 739-8526, Japan.
Xantheas SS; Physical Sciences Division, Pacific Northwestern National Laboratory, 902 Battelle Boulevard, P. O. Box 999, MS K1-83, Richland, Washington 99352, USA.

Phys Chem Chem Phys ; 18(29): 19746-56, 2016 Jul 20.

Article em En | MEDLINE | ID: mdl-27385069

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: Phys Chem Chem Phys Assunto da revista: BIOFISICA / QUIMICA Ano de publicação: 2016 Tipo de documento: Article País de afiliação: Japão

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