Effects of intermolecular interaction on proton tunneling: Theoretical study on two-dimensional potential energy surfaces for 9-hydroxyphenalenone-CO2/H2O complexes

Hirotoshi Mori, Hiroshi Sekiya, Eisaku Miyoshi, Koichi Mogi, Yoshiko Sakai

    Research output: Contribution to journalArticle

    5 Citations (Scopus)

    Abstract

    The effects of intermolecular interactions on proton tunneling dynamics in the 9HPO-CO2 and 9HPO-H2O complexes was theoretically investigated. Theoretical results were compared with the spectroscopic results on jet-cooled 9HPO-CO2 and 9HPO-H2O of previous studies. Overall, significant results were obtained.

    Original languageEnglish
    Pages (from-to)4159-4165
    Number of pages7
    JournalJournal of Chemical Physics
    Volume119
    Issue number8
    DOIs
    Publication statusPublished - Aug 22 2003

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    Potential energy surfaces
    Protons
    potential energy
    protons
    interactions

    All Science Journal Classification (ASJC) codes

    • Physics and Astronomy(all)
    • Physical and Theoretical Chemistry

    Cite this

    Effects of intermolecular interaction on proton tunneling : Theoretical study on two-dimensional potential energy surfaces for 9-hydroxyphenalenone-CO2/H2O complexes. / Mori, Hirotoshi; Sekiya, Hiroshi; Miyoshi, Eisaku; Mogi, Koichi; Sakai, Yoshiko.

    In: Journal of Chemical Physics, Vol. 119, No. 8, 22.08.2003, p. 4159-4165.

    Research output: Contribution to journalArticle

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    AU - Mogi, Koichi

    AU - Sakai, Yoshiko

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