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Quantum mechanical molecular interactions for calculating the excitation energy in molecular environments: a

Jun-Ya Hasegawa1, Kazuma Yanai, Kazuya Ishimura

  • 1Catalysis Research Center, Hokkaido University, Kita 21, Nishi 10, Kita-ku, Sapporo, 011-0021 (Japan); JST-CREST, 4-1-8 Honcho, Kawaguchi, Saitama, 332-0012 (Japan). hasegawa@cat.hokudai.ac.jp.

Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|November 14, 2014
PubMed

Keywords:
decomposition analysisdispersion effectsexcited statespolarization effectssolute-solvent clusters

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