Quadratic description of conical intersections: Characterization of critical points on the extended seam

Journal of Physical Chemistry A

Volumn 111, Issue 11, 2007, Pages 2182-2192

  Sicilia, Fabrizio ^a   Blancafort, Lluís ^b   Bearpark, Michael J ^a   Robb, Michael A ^a  

^a IMPERIAL COLLEGE LONDON   (United Kingdom)

^b UNIVERSITY OF GIRONA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; COMPUTER SIMULATION; PHOTOCHEMICAL REACTIONS; QUANTUM THEORY; VIBRATIONAL SPECTRA;

CONICAL INTERSECTIONS; CRITICAL POINTS; SECOND-DERIVATIVE TECHNOLOGY;

MOLECULAR DYNAMICS;

1,3 BUTADIENE DERIVATIVE; FREE RADICAL;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; PHOTOCHEMISTRY;

BUTADIENES; FREE RADICALS; MODELS, CHEMICAL; PHOTOCHEMISTRY;

EID: 34047211693     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp067614w     Document Type: Article

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