CCL: primitive unit cell from CIF file
- From: Tapas Kar <tapas.kar|-|usu.edu>
- Subject: CCL: primitive unit cell from CIF file
- Date: Thu, 30 Jul 2009 07:34:22 -0600
Sent to CCL by: Tapas Kar [tapas.kar _ usu.edu]
Try ORTEP (http://www.ornl.gov/sci/ortep/ortep.html)
> From: owner-chemistry+tapas.kar==usu.edu[#]ccl.net [mailto:owner-chemistry+tapas.kar==usu.edu[#]ccl.net] On Behalf Of Mudit
dixit dixitmuditk ~ gmail.com
Sent: Thursday, July 30, 2009 1:47 AM
To: Tapas Kar
Subject: CCL: primitive unit cell from CIF file
Sent to CCL by: "Mudit dixit" [dixitmuditk++gmail.com]
I was wondering if there is a simple (free) utility for producing a
primitive cell (not conventional) from an asymmetric cell and space group.
Basically, I want to be able to easily go from a crystallographic
information file to a primitive unit cell. I have material studio, but I dont
know how to do it.
Any help would be appreciated.
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