[Pw_forum] Primitive cell Anatase regarding.

Suresh A suresh2007pgp19 at gmail.com
Mon Jul 11 07:00:59 CEST 2016

Dear All,

I did calculation for anatase primitive cell and conventional cell.
I get atomic positions of these cells from previous posts in this forum.
I do know to get wyckoff positions of conventional cell from space
group I41/amd and
from bilbao crystallographic server. Now I need to know to get wyckoff
positions of
primitive cell which is posted in this forum as follows.And how to get it from
bilbao crystallographic server.
Ti (0,0,0)
Ti (0,a/2,c/4)
O (0,0,-uc)
O (0,0,+uc)
O (0,a/2,c/4-uc)
O (0,a/2,c/4+uc


                  With Regards,
Research Scholar,
Madurai Kamaraj University,
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