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From: "Stephen E. Derenzo" <sederenzo@lbl.gov>
To: forum@abinit.org
Subject: [abinit-forum] cancel
Date: Thu, 2 Jul 2009 06:22:22 -0700

cancel

please cancel subscription to forum

Stephen

On Jul 2, 2009, at 6:04 AM, Prasun Sharma Chowdhury wrote:

Dear all,
Can anyone tell me what should be difference between the .in files constructed on space group P6/mmm and P63/mmc? actually i followed the following links..

http://cst-www.nrl.navy.mil/lattice/struk/a_f.html
http://cst-www.nrl.navy.mil/lattice/struk/a3.html

and they showed a diference in basis vectors... i.e. a difference in xred. but when i am inserting the xred for P63/mmc (i.e. 1/3 2/3 1/4), the output shows that the sp grp is P6/mmm! pls help me..

prasun

[abinit-forum] hexagonal space groups, Prasun Sharma Chowdhury, 07/02/2009
- [abinit-forum] cancel, Stephen E. Derenzo, 07/02/2009