Electronic structure and spectroscopy of oxyallyl: A theoretical study

Journal of Physical Chemistry A

Volumn 114, Issue 26, 2010, Pages 6935-6943

  Mozhayskiy, Vadim ^a   Goebbert, Daniel J ^b   Velarde, Luis ^b   Sanov, Andrei ^b   Krylov, Anna I ^a  

^a UNIVERSITY OF SOUTHERN CALIFORNIA   (United States)

^b University of Arizona   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; ELECTRONIC STATES; ELECTRONIC STRUCTURE; PHOTOELECTRON SPECTROSCOPY; PHOTOELECTRONS; PHOTONS; POTENTIAL ENERGY; QUANTUM CHEMISTRY; WAVE PACKETS;

ADIABATIC ENERGY DIFFERENCE; ENERGY DIFFERENCES; GEOMETRIC RELAXATION; LOW LYING ELECTRONIC STATE; PHOTODETACHMENT SPECTRUM; PHOTOELECTRON SPECTRUM; TWO-DIMENSIONAL SCAN; WAVE PACKET CALCULATION;

NEGATIVE IONS;

EID: 77954346955     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp102183z     Document Type: Article

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