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Proceedings Paper

Adiabatic potential energy surfaces of the vinoxy radical
Author(s): K. Piechowska; M.-C. Bacchus-Montabonel; Y. S. Tergiman; J. E. Sienkiewicz
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Paper Abstract

The three adiabatic potential surfaces of the vinoxy radical are calculated. They describe the ground and two lowest excited states. We employ the MCSCF (CASSCF) method using the MOLPRO package.

Paper Details

Date Published: 1 June 2005
PDF: 3 pages
Proc. SPIE 5849, Fifth Workshop on Atomic and Molecular Physics, (1 June 2005); doi: 10.1117/12.629521
Show Author Affiliations
K. Piechowska, Lab. de Spectrometrie Ionique et Moleculaire, CNRS, Univ. Lyon I (France)
Gdansk Univ. of Technology (Poland)
M.-C. Bacchus-Montabonel, Lab. de Spectrometrie Ionique et Moleculaire, CNRS, Univ. Lyon I (France)
Y. S. Tergiman, Lab. de Spectrometrie Ionique et Moleculaire, CNRS, Univ. Lyon I (France)
J. E. Sienkiewicz, Gdansk Univ. of Technology (Poland)


Published in SPIE Proceedings Vol. 5849:
Fifth Workshop on Atomic and Molecular Physics
Jerzy Kwela; Ryszard Drozdowski; Tomasz J. Wasowicz, Editor(s)

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