A Lanczos-chain driven approach for calculating damped vibrational configuration interaction response functions

Journal of Chemical Physics

Volumn 133, Issue 11, 2010, Pages

  Hansen, Mikkel Bo ^a   Seidler, Peter ^a   Gyrffy, Werner ^b   Christiansen, Ove ^a  

^a AARHUS UNIVERSITY   (Denmark)

^b UNIVERSITY OF STUTTGART   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

COMPLEX DAMPING; CYCLOPROPENES; FIRST HYPERPOLARIZABILITIES; LANCZOS; LANCZOS METHODS; POLARIZABILITIES; RESPONSE EQUATIONS; RESPONSE FUNCTIONS; RESPONSE MATRICES; TRIDIAGONAL; VIBRATIONAL CONFIGURATION-INTERACTION; VIBRATIONAL CONTRIBUTIONS;

PROPYLENE;

EID: 77956962044     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3467889     Document Type: Article

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