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Reproduction of ab initio electrostatic potential with classical fractional point charges.
KUBODERA, HIDEO, NAKAGAWA, SETSUKO, UMEYAMA, HIDEAKIVolume:
35
Year:
1987
Language:
english
Journal:
CHEMICAL & PHARMACEUTICAL BULLETIN
DOI:
10.1248/cpb.35.1673
File:
PDF, 1.94 MB
english, 1987