Geometry optimization of charged molecules in an external electric field applied to F-·H2O and I-·H2O

Journal of Physical Chemistry A

Volumn 102, Issue 8, 1998, Pages 1365-1370

  Kairys, Visvaldas ^a   Head, John D ^a  

^a UNIVERSITY OF HAWAII   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; CONSTRAINT THEORY; ELECTRIC FIELD EFFECTS; ELECTRODES; FLUORINE COMPOUNDS; IODINE COMPOUNDS; MATHEMATICAL MODELS; MOLECULAR VIBRATIONS; OPTIMIZATION;

GEOMETRY OPTIMIZATION; VIBRATIONAL FREQUENCIES;

MOLECULAR DYNAMICS;

EID: 0031998862     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp9722824     Document Type: Article

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