Conformational effects on the ultraviolet absorption spectrum of n-Tetrasilane: Multistate complete active space second-order perturbation theory treatment

Journal of Physical Chemistry A

Volumn 106, Issue 42, 2002, Pages 9868-9873

  Piqueras, Mari Carmen ^a   Merchán, Manuela ^a   Crespo, Raül ^a   Michl, Josef ^b  

^a UNIVERSITY OF VALENCIA   (Spain)

^b UNIVERSITY OF COLORADO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION SPECTROSCOPY; CALCULATIONS; CHEMICAL BONDS; CONFORMATIONS; ELECTRON ENERGY LEVELS; ELECTRON TRANSITIONS; MOLECULAR STRUCTURE; OPTIMIZATION; PERTURBATION TECHNIQUES; QUANTUM THEORY; ULTRAVIOLET SPECTROSCOPY;

ATOMIC NATURAL ORBITALS; GAUCHE CONFORMER; LOW-ENERGY VALENCE ELECTRONIC EXCITED STATE; TETRASILANE; ULTRAVIOLET ABSORPTION SPECTRA;

SILANES;

EID: 0037168347     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp020460+     Document Type: Article

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