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Title:Multistate vibronic Hamiltonian for the nitrate radical
Author(s):Stanton, John F.
Subject(s):Radicals
Abstract:The quasidiabatic model of K{\"o}ppel, Domcke and Cederabaum has proven to be a powerful tool for computing intensities and level positions in electronic spectra involving strong vibronic coupling effects. The model has been used, as parametrized by very high-level equation-of-motion coupled cluster (EOM-CC) calcaultions, is demonstrated by applications to the NO$_3$ radical.
Issue Date:2014-06-16
Publisher:International Symposium on Molecular Spectroscopy
Citation Info:Stanton, J.F. MULTISTATE VIBRONIC HAMILTONIAN FOR THE NITRATE RADICAL. Proceedings of the International Symposium on Molecular Spectroscopy, Urbana, IL, June 16-21, 2014. DOI: 10.15278/isms.2014.MI15
Genre:Conference Paper / Presentation
Type:Text
Language:English
URI:http://hdl.handle.net/2142/59150
DOI:10.15278/isms.2014.MI15
Rights Information:Copyright 2014 by the authors. Licensed under a Creative Commons Attribution 4.0 International License. http://creativecommons.org/licenses/by/4.0/
Date Available in IDEALS:2014-12-08
2015-04-14


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