Termocromismo em soluções de alcóxidos de Vanádio(IV): uma abordagem pela modelagem molecular Thermochromic behavior of vanadium(IV) alkoxides in solution: a molecular modeling aproach

Termocromismo em soluções de alcóxidos de Vanádio(IV): uma abordagem pela modelagem molecular Thermochromic behavior of vanadium(IV) alkoxides in solution: a molecular modeling aproach

<abstract language="eng">The thermochromic behavior exhibited by vanadium(IV) alkoxides, [V2(&#956;-OPr i)2(OPr i) 6] and [V2(&#956;-ONep)2(ONep)6 ], OPr i = isopropoxide and ONep = neopentoxide, was studied by molecular modeling using DFT, TDDFT and INDO/S methods. The vibra...

Full description

Bibliographic Details
Main Authors: Alexandre C. de Freitas, Kátia C. M. Westrup, Giovana G. Nunes, Denis J. Gulin, Roberto L. A. Haiduke, Jaísa F. Soares, Eduardo L. de Sá
Format: Article
Language:English
Published: Sociedade Brasileira de Química 2010-01-01
Series:Química Nova
Subjects:
thermochromism
vanadium(IV) alkoxides
molecular modeling
Online Access:http://www.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422010000100011

Internet

http://www.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422010000100011

Similar Items