I opened the struct file with Xcrysden and I found that the primitive cell has a=b=c. Now, I am convinced for 10x10x10 k-points. Thank you very much for your reply.
****************************************************** Nacir GUECHI Dr. Physique de la matière solide.Enseignant-Chercheur à l'université du Dr. Yahia FARES de Médéa, Algeria (www.univ-media.dz).Laboratoire d'études des surfaces et interfaces des matériaux solides (L.E.S.I.M.S), université Sétif1 (Algeria)http://laboratoires.univ-setif.dz/L.E.S.I.M.S/ Le mardi 17 juillet 2018 à 14:19:02 UTC+1, t...@theochem.tuwien.ac.at <t...@theochem.tuwien.ac.at> a écrit : Hi, kgen generates the k-points for the primitive cell, which has a=b=c in your case (open your struct file with xcrysden and press F3 to see the primitive cell). F. Tran > thank you for reply. > my query is: why the same number 10 in the plane and out-plane? _______________________________________________ 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
_______________________________________________ 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