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Hydrogen bonding in the benzene–ammonia dimer

✍ Scribed by Rodham, David A.; Suzuki, Sakae; Suenram, Richard D.; Lovas, Frank J.; Dasgupta, Siddharth; Goddard, William A.; Blake, Geoffrey A.

Book ID: 109783973
Publisher: Nature Publishing Group
Year: 1993
Tongue: English
Weight: 346 KB
Volume: 362
Category: Article
ISSN: 0028-0836
DOI: 10.1038/362735a0

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## Abstract __Ab initio__ complete optimizations at MP2/6‐31++G\*\* level have been performed in the T‐shaped geometry of the benzene–benzene and benzene–naphthalene complexes. To check the effect of the basis set superposition error (BSSE), optimizations have been done in the BSSE corrected and BS