[molpro-user] FW: Check if bands are infrared active
Freeh Sophia
freehsophia at gmail.com
Fri Aug 26 15:40:22 BST 2011
Dear Molpro user,
I am doing some harmonic frequency calculations on CH3OOH. Apology for my
following basic question. Does anyone know how to check if the calculated
vibrational band is infrared active?
Best wishes,
Gang
Freeh Sophia
Marketing GmbH
Emanuelstr. 3,
10317 Berlin
Deutschland
Telefon: +49 (33) 5310967
Email: freehsophia at gmail.com
Site: http://flug.airego.de/
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