CCL: How can I print forces
- From: Víctor Luaña Cabal
<victor::fluor.quimica.uniovi.es>
- Subject: CCL: How can I print forces
- Date: Fri, 18 Sep 2015 17:46:49 +0200
Sent to CCL by: =?iso-8859-1?Q?V=EDctor_Lua=F1a?= Cabal
[victor]=[fluor.quimica.uniovi.es]
On Thu, Sep 17, 2015 at 11:40:04AM -0400, samala nagaprasad reddy
snpreddy63###gmail.com wrote:
> Hello All,
> I am calculating numerical frequencies in Molpro. When I check the
> outputs (out and log files), its not printing the forces. I hope there
> should be some options to print it. I have gone through the manual and
> didn't find. I will be thankful to them if some one helps in this regard.
Samala,
Maybe you could try to be more creative uding google: 'molpro print force
constants' gives you something to try.
<http://www.molpro.net/info/2010.1/doc/manual/node596.html>º;
Good luck,
Víctor Luaña
--
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