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From: | Sarah MohammadiNejad |
Subject: | [ESPResSo-users] Fixing (Unfixing) dipoles in Espresso |
Date: | Wed, 1 Feb 2012 15:49:28 +0330 |
User-agent: | SquirrelMail/1.4.21 |
Dear users & organizers,
Hi,
I am going to model a
dipole system in ESPResSo. I need some dipoles to be fix and others not.
In archive of ESPResSo mailing list, I saw that for fixing a dipole I
should just disable the feature "Rotation" in myconfig header
file. But as I mentioned I need some of my dipoles free to rotate and
disabling "Rotation" will fix all of my dipoles. So I think this
solution is not suitable for my system. Am I right? If yes, is there any
way to fix just some of dipoles in ESPResSo?
Thanks in advance
Sarah
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