Dear Sajjad, you still is next to no information - I doubt anybody can help you.
One of the first things you should do is take a look into the dayfile (if you use w2web its in the utilities menu). Did you succeed with any calculations on your Lenovo laptop? -->If no, try TiC, following the UG until it works. -->If yes, did you succeed to run a SCF with that struct file? Maybe in a fresh directory (new case)? -->>If no, did you use w2web? At least for the setup? Were there any errors/warnings during initialization? -->>If yes, what did you change after the successful run? I am a little suspicious about you mentioning 'lapw2c': Is this a complex case (magnetic or without inversion)? Best luck, Martin Pieper On Thu, 18 Apr 2013 23:51:18 +0800, Muhammad Sajjad <sajja...@gmail.com> wrote: > Respected members > > Sorry, some text was missing in the first mail. Please read the following > now. > > I am using wien2k_12 version. I tried to perform an SCF for a transition > metal doped CdTe for 25 percent doping concentration. My system is Lenovo > (laptop) core i5 with 4GB RAM. > When SCF starts, it proceeds as > Show STDOUT > > LAPW0 END > LAPW1 END > LAPW1 END > After this, SCF runs for long time on *lapw2c. * > > *When *I checked the error file, then found an error " error in lapw2" > > Please help me to overcome this problem. > > True Regards > > M. Sajjad -- Dr. Martin Pieper Karl-Franzens University Experimentalphysik Universitätsplatz 5 A-8010 Graz Austria Tel. +43-316-380-8564 _______________________________________________ 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