Dear all, When i use 'x wplot -wf 1' in wien2wannier, an error came out:
Local rotation matrix not orthogonal i use the template, case.inwplot. what should i edit it? Looking for your reply. With regards! _______________________________________________ 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