Hi,
I would like to know where is the best place to look for Lennard Jones
parameters for molecules (and not atoms) for example for CH_3CN, HC_3N,
C_2H_5N. Thus I need LJ sigma and epsilon parameters for molecules and not
individual atoms.
Any reference, link, suggestion would be more than helpful!
THanks,
Ioana
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* Ioana Cozmuta, PhD * *
* NASA-AMES Research Center * "Gravitation can not be held responsible*
* Mail Stop 230-3 * for people falling in love" *
* Moffet Field,CA 94035 * *
* phone: (650) 604-0993 * Albert Einstein*
* fax: (650) 604-0350 * (1879-1955) *
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Received on Tue Jul 15 2003 - 01:53:01 PDT
