On 08/13/2014 08:05 AM, 田丰 wrote:
1. normal SCF run. 2. change the 'tetra' in file .in2 to 101. 3. run step by step of Optic in w2web.However when I click 'x joint -up(dn)' error message is reported as following: opmat allocated with kkk,nemax1,ncol 560 12 2 ( 0 MB) forrtl: severe (24): end-of-file during read, unit 4, file /home/lapw/fccNi.weightup
You need to run ‘x lapw2 -fermi’ to get the ‘weight’ files. -- Elias Assmann Institute of Solid State Physics Vienna University of Technology <http://www.ifp.tuwien.ac.at/cms/> _______________________________________________ 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
