Re: [Wien] Regarding bandstructure calculation in WIEN2k 17.1

Thank you so much. I will give it a try. Regards, Mohaddeseh On 4/20/18, Gavin Abo wrote: > It depends on what Linux distribution you are using. > > For example, if you are using Ubuntu, evince should be the default > PostScript viewer [

Re: [Wien] Regarding bandstructure calculation in WIEN2k 17.1

It depends on what Linux distribution you are using. For example, if you are using Ubuntu, evince should be the default PostScript viewer [ https://help.ubuntu.com/community/Evince ].  If not installed, you should be able to install it with: sudo apt-get install evince If you are using

Re: [Wien] Regarding bandstructure calculation in WIEN2k 17.1

Dear Gavin Abo, Thank you very much for your help. I could solve it. However, I can not have the PostScript format in the w2web. However, it saves correctly. Is there any way to have it? Regards, Mohaddeseh On 4/20/18, Gavin Abo wrote: > There are fixed band.pl and scf.pl

Re: [Wien] Regarding bandstructure calculation in WIEN2k 17.1

There are fixed band.pl and scf.pl files for WIEN2k 17.1 [1-4] in the post [1] that you can use (or band.patch and scf.patch [5,6] at [7] could be used instead). If you choose to use the patch files.  The following is what I do. First, I go to [7].  I click on band.patch on the webpage, then

[Wien] Regarding bandstructure

Resp. all I am facing one problem in calculating the band structure. I am using the wien2k code for my calculations, so when i calculated the band-structure it shows the direct band gap nature but the previously calculation where they use the Quantum-ESPRESSO code shows indirect band gap nature. I

Re: [Wien] Regarding bandstructure

eff: [Wien] Regarding bandstructure Resp. all I am facing one problem in calculating the band structure. I am using the wien2k code for my calculations, so when i calculated the band-structure it shows the direct band gap nature but the previously calculation where they use the Quantum-ESPRESSO

[Wien] Regarding Bandstructure

Dear All I have problem in calculating the band structure, so i saw this email on the wien2k site Thank you very much for this report and the analysis. It will be updated in the next version of WIEN2k. Am 16.01.2012 18:30, schrieb Muechler, Lukas: Hey everyone, I've bee having an issue with

Re: [Wien] Regarding Bandstructure

Hello sikander, It's not a configuration file but a source code file, the can be found at $WIENROOT/SRC_spaghetti/spag.f I see that in wien2k 13 it's been updated to 9. If you change it you'll have to recompile spaghetti. Regards, Michael Sluydts sikandar azam schreef op 25/02/2014