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Simulations of infrared and Raman spectra in solution using the fragment molecular orbital method

Hiroya Nakata1, Dmitri G Fedorov2

  • 1R & D Center Kagoshima, Kyocera, 1-4 Kokubu Yamashita-cho, Kirishima-shi, Kagoshima, 899-4312, Japan. hiroya.nakata.gt@kyocera.co.jp.

Physical Chemistry Chemical Physics : PCCP
|June 13, 2019
PubMed

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