Yeah, you need to use at least 3.0 denchar. Den tor. 21. jan. 2021 kl. 15.24 skrev Nick Papior <nickpap...@gmail.com>:
> From which version of siesta did you take this version? > > Den tir. 19. jan. 2021 kl. 22.01 skrev El-abed Haidar < > ehai2...@uni.sydney.edu.au>: > >> 2.2 >> >> >> >> El-abed Haidar | Doctor of Philosophy (Science) >> Condensed Matter Theory (CMT) Group| School of Physics >> THE UNIVERSITY OF SYDNEY | NSW | 2006 >> >> >> ------------------------------ >> *From:* siesta-l-requ...@uam.es <siesta-l-requ...@uam.es> on behalf of >> Nick Papior <nickpap...@gmail.com> >> *Sent:* Tuesday, January 19, 2021 2:01:27 AM >> *To:* siesta-l <siesta-l@uam.es> >> *Subject:* Re: [SIESTA-L] Denchar command "denchar -k 3 -w 4 file.fdf " >> not working ? >> >> Which version of denchar did you work with? >> >> >> Den lør. 16. jan. 2021 kl. 22.01 skrev El-abed Haidar < >> ehai2...@uni.sydney.edu.au>: >> >> Good evening, >> >> I was trying to use dencar command denchar -k 3 -w 4 file.fdf which >> will plot only the wave-function with (original) index 4 of the third >> k-point in the (WFSX) file. >> >> But when I tried to use it in denchar 2.2 it just would not go through >> the specified k point nor wave function. >> >> Is there a reason?? >> >> Here is my proof in the update file where I used the command : denchar -k >> 3 -w 4 file.fdf >update.txt. >> >> Denchar works but not as commanded >> >> Any advice ? >> >> Thank you and looking forward to your reply. >> EL-abed >> >> >> >> El-abed Haidar | Doctor of Philosophy (Science) >> Condensed Matter Theory (CMT) Group| School of Physics >> THE UNIVERSITY OF SYDNEY | NSW | 2006 >> >> >> >> -- >> SIESTA is supported by the Spanish Research Agency (AEI) and by the >> European H2020 MaX Centre of Excellence (http://www.max-centre.eu/ >> <https://protect-au.mimecast.com/s/_AD9CGv0oyCMJB2jTKGm-W?domain=max-centre.eu/> >> ) >> >> >> >> -- >> Kind regards Nick >> >> -- >> SIESTA is supported by the Spanish Research Agency (AEI) and by the >> European H2020 MaX Centre of Excellence (http://www.max-centre.eu/) >> > > > -- > Kind regards Nick > -- Kind regards Nick
-- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)
