Dear QE experts, Thank you very much for your consideration,
Dear Sterfano Thank you very much, I did what you explain, but the code ask for other information. what is threshold? what is ncri? Best wishes, Abdullah ________________________________ From: [email protected] [[email protected]] on behalf of stefano de gironcoli [[email protected]] Sent: Sunday, September 04, 2016 12:54 PM To: PWSCF Forum Subject: Re: [Pw_forum] About using plotproj.x Dear Abdullah, The first is a file with the band eigenvalues, written in the output of pw.x. just take the output of pw.x the one used to produce the projection and cut out the eivenvaulues section adding nbnd and nks on top The second file is written by the projwfc.x program with the option lsym=.false. should be the file corresponding to filproj in projwfc.x namelist stefano ________________________________ This email and any files transmitted with it are confidential and intended solely for the use of the individual or entity to whom they are addressed. If you have received this email in error please notify Email System Administrator ([email protected] ) . Please note that any views or opinions presented in this email are solely those of the author and do not necessarily represent those of the Umm Al-Qura University. Finally, the recipient should check this email and any attachments for the presence of viruses. The Information Technology and Technical Support Center of Umm Al-Qura University accepts no liability for any damage caused by any virus transmitted by this email.
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