Ab initio study of lower energy phenol-water1≤n≤4 complexes: Interpretation of two distinct infrared patterns in spectra of phenol-water tetramer

Journal of Physical Chemistry A

Volumn 106, Issue 5, 2002, Pages 731-742

  Kryachko, Eugene S ^a   Hiroshi, Nakatsuji ^b  

^a UNIVERSITY OF LEUVEN   (Belgium)

^b KYOTO UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

POTENTIAL ENERGY SURFACES (PES);

HYDROGEN BONDS; INFRARED SPECTROSCOPY; ISOMERS; PHENOLS; POTENTIAL ENERGY; WATER;

MOLECULAR DYNAMICS;

EID: 0037034415     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp012203v     Document Type: Article

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