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GU: mass-weighted cartesian coordinates ?

To: gamess-users@glue.umd.edu
Subject: GU: mass-weighted cartesian coordinates ?
From: chamma@univ-perp.fr (didier Chamma)
Date: Fri, 5 Jul 1996 09:21:21 GMT
Delivery-date: Fri, 05 Jul 1996 06:35:50 -0400
Reply-to: gamess-users@glue.umd.edu
Sender: owner-gamess-users@glueserv1.umd.edu

Dear GAMESS users,

Can anyone explain to me how GAMESS make an IRC run in 'mass-weighted cartesian coordinates' ?
Why are the 'STOTAL DISTANCE' 's units bohr-sqrt(amu) ?

Thanks in advance.


D. CHAMMA
IMP-CNRS
University of Perpignan
FRANCE

e-mail : chamma@gala.univ-perp.fr

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