vibrational frequencies and potential energy surface
- From: cbiot
^at^ ulb.ac.be
- Organization: ULB
- Subject: vibrational frequencies and potential energy surface
- Date: Tue, 29 Apr 2003 16:07:11 +0000
Dear all,
I am looking for bibliographic references dealing with vibrational
frequencies and potential energy surface.
Could the frequencies be calculated for each point of the surface or
only at a minimum?
Any reply would be greatly appreciated.
Thanks in advance.
CB
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Dr. BIOT Christophe
Ingénierie Moléculaire et Biomoléculaire, CP 165/64
Université Libre de Bruxelles
50 Av. F.D. Roosevelt
1050 Bruxelles, BELGIQUE
Phone: 32-2-650 3001
Fax: 32-2-650 3606
E-mail:cbiot ^at^ ulb.ac.be
http://babylone.ulb.ac.be/~christophe/
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