t3x.files and other examples in tutorial 3
Posted: Sun May 15, 2011 11:29 am
Hi,
I have a problem with running tutorial 3 codes. It takes long time and I stop it. It is said in the tutorial that it must take a few seconds to be completed. But it takes long time and never completes. The input file is copied from the source that is said in the tutorial. The log file stopped at line 463 which is "dtsetcopy : copying area nband the actual size ( 2) of the index ( 1) differs from its standard size ( 1)" and the output file stopped after citation "Exchange-correlation functional for the present dataset will be: LDA: new Teter (4/93) with spin-polarized option - ixc=1".
I truly appreciate your time and consideration.
Regards,
Ali
I have a problem with running tutorial 3 codes. It takes long time and I stop it. It is said in the tutorial that it must take a few seconds to be completed. But it takes long time and never completes. The input file is copied from the source that is said in the tutorial. The log file stopped at line 463 which is "dtsetcopy : copying area nband the actual size ( 2) of the index ( 1) differs from its standard size ( 1)" and the output file stopped after citation "Exchange-correlation functional for the present dataset will be: LDA: new Teter (4/93) with spin-polarized option - ixc=1".
I truly appreciate your time and consideration.
Regards,
Ali