Re: [Wien] Need help

Dear Lawal, You have to run in Terminal as a separate command. Yours, Rahnama   Dr. H.A.Rahnamaye Aliabad, Assistant Professor, Department of physics,Hakim Sabzevari University, Sabzevar,Iran Tel:+98-571-4003155 Fax:+98-571-4411161 Academic email:rahn...@hsu.ac.ir On Wednesday, January 8, 2014 8

[Wien] Need help

Dear Developers and users, I have got a problem. I am using wien2k 11 version. I don't know where to locate rhomb_in5 program in w2web. Can someone please help on how to use the program?   Regards Lawal ___ Wien mailing list Wien@zeus.theochem.tuwien.ac

[Wien] Print plane wave coefficients flom LAPW1 with -p option

Dear Users and Developers, I attempt to print WF coefficients using the option 'WFPRI' in 'case.in1(c)' file. It works well for a serial run, but fails in MPI-parallel execution (x lapw1 -p). The program crashes with a segmentation fault after eigenvalues for the first k-point are written in case.

Re: [Wien] papers published with Wien2k

Ops !! thank you ! I did not notice there was such a tool...sorry. Fabiana 2014/1/7 Masood Yousaf > Dear Tendeloo > > A short, quick and convenient way is to insert your publication through > the fallowing form. After they will appear on the list soon. > > http://www.wien2k.at/papers/publ_inp

Re: [Wien] papers published with Wien2k

Dear Tendeloo A short, quick and convenient way is to insert your publication through the fallowing form. After they will appear on the list soon. http://www.wien2k.at/papers/publ_input1.html Best wishes Masood On Tuesday, January 7, 2014 11:17 PM, Fabiana Da Pieve wrote: Dear Wien2k d

[Wien] papers published with Wien2k

Dear Wien2k developers I totally forgot to say that in the last two years I have published two (very simple, from what concerns my contribution) papers with Wien2k, in collaboration with some experimentalists. In the (likely, or unlikely, depends on you) case you want to add them on the website