"Enhancement of energy decomposition analysis in fragment molecular orbital ..."

Sota Matsuoka et al. (2024)

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DOI: 10.1002/JCC.27297

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type: Journal Article

metadata version: 2024-04-15

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Sota Matsuoka, Kota Sakakura, Yoshinobu Akinaga, Kazuki Akisawa, Koji Okuwaki, Hideo Doi, Yuji Mochizuki:
Enhancement of energy decomposition analysis in fragment molecular orbital calculations. J. Comput. Chem. 45(12): 898-902 (2024)

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