[Pw_forum] forming super cell - reg.,

Muthu V muthu.physicsmath at gmail.com
Wed Jan 22 02:27:55 CET 2014


Dear QE users

i want to create supercell of Si and iO2 from their unitcell. i searched
and there are some topics on this issue in this forum

*Tone Kokalj* tone.kokalj at ijs.si
<xcrysden%40democritos.it?Subject=%5Bxcrysden%5D%20simple%20question%20about%20building%20supercells&In-Reply-To=20120316204519.M14952%40proto.fisica.ufmg.br>
*Wed Mar 21 11:24:27 CET 2012*

nut it still not working for both Si and TiO2. can anyone help in this
regard. ie how to get atomic coordinates of super cell build using xcrysden.

thank you

*_________________________*



*Muthu.VMadurai Kamaraj University__________________________*
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