Hydrogen bonding structure and many-body interactions in 1,3,5-triazine-(water)3 and 1,2,4-triazine-(water)3 complexes

International Journal of Quantum Chemistry

Volumn 107, Issue 3, 2007, Pages 567-573

  Li, Quan ^a   Huang, Fang Qian ^a  

^a SICHUAN NORMAL UNIVERSITY   (China)

Author keywords

1,2,4 triazine (water)3; 1,3,5 triazine (water)3 complexes; Density functional theory; Many body interactions

Indexed keywords

AROMATIC COMPOUNDS; COMPUTER SIMULATION; HYDROGEN BONDS; MOLECULAR DYNAMICS; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY;

1,2,4-TRIAZINE-(WATER)3; 1,3,5-TRIAZINE-(WATER)3 COMPLEXES; MANY-BODY INTERACTIONS;

MOLECULAR STRUCTURE;

EID: 33846319396     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.21158     Document Type: Article

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