"Trajectory on-the-fly molecular dynamics approach to tunneling splitting ..."

Yusuke Ootani et al. (2020)

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DOI: 10.1002/JCC.26199

access: closed

type: Journal Article

metadata version: 2020-10-26

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Yusuke Ootani, Aya Satoh, Yu Harabuchi, Tetsuya Taketsugu:
Trajectory on-the-fly molecular dynamics approach to tunneling splitting in the electronic excited state: A case of tropolone. J. Comput. Chem. 41(16): 1549-1556 (2020)

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