Premium
Cover Image, Volume 37, Issue 14
Publication year - 2016
Publication title -
journal of computational chemistry
Language(s) - English
Resource type - Reports
SCImago Journal Rank - 0.907
H-Index - 188
eISSN - 1096-987X
pISSN - 0192-8651
DOI - 10.1002/jcc.24388
Subject(s) - cover (algebra) , citation , image (mathematics) , computer science , combinatorics , information retrieval , library science , artificial intelligence , mathematics , engineering , mechanical engineering
On page 1321 (DOI: 10.1002/jcc.24347 ) Lei Gao, Yanli Zeng, Xueying Zhang, and Lingpeng Meng analyze the σ ‐hole of M 2 H 6 and π ‐hole of MH 3 , where in both cases M = Al, Ga, or In. Bimolecular complexes M 2 H 6 ···NH 3 and MH 3 ···N 2 P 2 F 4 were constructed to carry out comparative studies on group III σ ‐hole and π ‐hole interactions. Both types of interactions are partial‐covalent interactions, where the electrostatic energy provides the largest contribution.