The Matrix Isolation Spectrum of the CH₂⁺ Ion

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DOIResolve DOI: http://doi.org/10.1006/jmsp.2002.8636
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TypeArticle
Journal titleJournal of Molecular Spectroscopy
Volume216
Issue2
Pages419423; # of pages: 5
AbstractFor CH₂⁺ molecular ions at 5 K we simulate the infrared absorption spectrum, and tabulate all strong absorption lines from 0 to 16 000 cm⁻¹. We use ab initio potential energy, dipole moment, and transition moment surfaces in conjunction with our program system RENNER, which allows for the Renner-Teller effect and spin-orbit coupling in a full-dimensions calculation. This is done for the purpose of guiding our search for the matrix isolation spectrum; our attempts at finding this spectrum are also described.
Publication date
LanguageEnglish
AffiliationNational Research Council Canada; NRC Steacie Institute for Molecular Sciences
Peer reviewedNo
NPARC number12330740
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Record identifier80358adb-28e9-4000-9667-cf4cb49a1f1e
Record created2009-09-10
Record modified2016-05-09
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