CCL: Problem freezing atoms with gaussian
- From: Ben Sattelle
<ben.sattelle:+:postgrad.manchester.ac.uk>
- Subject: CCL: Problem freezing atoms with gaussian
- Date: Mon, 19 Sep 2005 17:37:44 +0100
Sent to CCL by: Ben Sattelle [ben.sattelle:+:postgrad.manchester.ac.uk]
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Alternatively, is there a different way to fix some
cartensian atomic positions?
i use -1, see ...
http://www.ccl.net/cgi-bin/ccl/message.cgi?2001+08+06+008
ben.