Hi, You may want to try VESTA: http://jp-minerals.org/vesta/en/
Regards Pascal Le 25 juin 2015 à 09:11, Fedor Bystrenko <fedor.bystre...@mail.ru> a écrit : > Hi, > Are there any utils in WIEN package for supercell creation? I'm interested > not just to enlarge the unit cell, but also to rotate it and cut a surface > along some direction. > For example, I take a unit cell of wurzite SiC and want to create a surface > with [10-10] orientation. Another question is how to rotate a crystal cell to > a given angle along one axis. Any advices/ papers/algorithms are appreciated. > Regards, > Fedor Bystrenko > _______________________________________________ > Wien mailing list > Wien@zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > SEARCH the MAILING-LIST at: > http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html -- Pascal Boulet - MCF HDR, Resp. L1 MPCI - DEPARTEMENT CHIMIE Aix-Marseille Université - ST JEROME - Avenue Escadrille Normandie Niemen - 13013 Marseille Tél: +33(0)4 13 55 18 10 - Fax : +33(0)4 13 55 18 50 Site : http://allos.up.univ-mrs.fr/pascal - Email : pascal.bou...@univ-amu.fr Afin de respecter l'environnement, merci de n'imprimer cet email que si nécessaire.
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
