Calculated and experimental geometries and infrared spectra of metal tris-acetylacetonates: Vibrational spectroscopy as a probe of molecular structure for ionic complexes. Part I

Journal of Physical Chemistry A

Volumn 105, Issue 1, 2001, Pages 238-244

  Diaz Acosta, Irina ^a   Baker, Jon ^a   Cordes, Wallace ^a   Pulay, Peter ^a  

^a UNIVERSITY OF ARKANSAS   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

INFRARED SPECTROSCOPY; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; MOLECULES; POLARIZATION; PROBABILITY DENSITY FUNCTION;

IONIC COMPLEXES; LIGAND; METAL TRISACETYLACETONATE COMPLEXES; NONLOCAL HYBRID DENSITY FUNCTIONAL THEORY; VIBRATIONAL SPECTROSCOPY;

ORGANOMETALLICS;

EID: 0035128009     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0028599     Document Type: Article

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