The Franck-Condon and Dushinsky effects in the lowest energy 1 2B3u doublet of the tetracyanoquinodimethane (TCNQ) monoanion: The absorption and resonance Raman studies in terms of the density functional theory (DFT) and complete active space self-consistent field (CASSCF) methods

Chemical Physics Letters

Volumn 388, Issue 4-6, 2004, Pages 367-373

  Makowski, Marcin ^a   Pawlikowski, Marek T ^a  

^a JAGIELLONIAN UNIVERSITY   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

ANION; METHANE;

ANALYTIC METHOD; ARTICLE; DENSITY FUNCTIONAL THEORY; ENERGY; ENERGY ABSORPTION; MATHEMATICAL ANALYSIS; MOLECULAR DYNAMICS; PHASE TRANSITION; RAMAN SPECTROMETRY;

EID: 1842637639     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.03.026     Document Type: Article

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