[Wien] Problem with Sulfur RMT SnS2
Osama Yassin
oyassin63 at gmail.com
Tue Dec 11 06:56:00 CET 2012
Dear Wien2k user,,
In literature SnS2 is reported to be a hexagonal with SG: P-3m1 (No. 164).
Sn and S have the coordinates (0,0,0) and (2/3, 1/3, z=0.25), respectively.
The lattice parameters are 3.648 and 5.899 A. Upon automatically setting
the RMT, I got RMT for S atom equals zero.
May you please explain why I got zero value and how to sort out this
problem.
--
*Osama *
*Prof Dr Osama Ali Yassin ** ** *
*Professor of Solid State Physics and ICTP regular associate*
*Department of Physics, Faculty of Science*
*Taibah University, A-Madinah Al-Munawarh, K. Saudi Arabia *
*
*
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20121211/6419819e/attachment.htm>
More information about the Wien
mailing list