A good starting point will be the mailing list search:
http://www.mail-archive.com/search?q=supercelll=wien%40zeus.theochem.tuwien.ac.at
Oleg
On Mon, Dec 30, 2013 at 8:53 AM, Mouna Mesbahi mouna.mesb...@yahoo.fr wrote:
Hello user’s wien2k
I want study the structure of Cu2SnS3 but in this structure Cu and Sn are in
the same position so
it might be possible to do the calculation instead with a supercell
can any one tell me How creating the supercell for partial occupancies
thank you in advance
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