Metal cation binding to phenol: DFT comparison of the competing sites

Journal of Physical Chemistry A

Volumn 106, Issue 32, 2002, Pages 7328-7337

  Dunbar, Robert C ^a  

^a CASE WESTERN RESERVE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

LIGANDS;

BENZENE; BINDING ENERGY; OXYGEN; POSITIVE IONS; PROBABILITY DENSITY FUNCTION; WATER;

PHENOLS;

EID: 0037104796     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp013588k     Document Type: Article

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