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Ab initio calculations of infrared transition rates in the ground states of BF and BF+

✍ Scribed by Pavel Rosmus; Hans-Joachim Werner; Michael Grimm

Publisher: Elsevier Science
Year: 1982
Tongue: English
Weight: 523 KB
Volume: 92
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(82)80270-4

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✦ Synopsis

Llcctnc dlpole moment functions and radiahre tr;msiuon rates haw been calculated ior the X '~+state of BF and the Y z~* swc oi BP irom MC SCF uavefunctlons.

Both ale prcdickd to be strong emitters m the infrared. For BF* the elcctromcally uvxed z~* state. corrcspondmg to the coniigunuon lo' 2a'30Z~05a21xQ,scalculated to bebound,uhcre3s

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