This is very strange, I have tried it again by constructing the same thing but in a new file... still the same error! maybe there is something wrong with the QE version i use...by the way I have already tried the quotation marks trick, it is still the same!!!
Kind regards, Amin ________________________________ From: users <[email protected]> on behalf of Giovanni Cantele <[email protected]> Sent: Monday, March 5, 2018 4:34:44 PM To: Quantum Espresso users Forum Subject: Re: [QE-users] band_structure_calculation unless I did something wrong, your input works for me. Maybe you have some hidden special character in the file that has not been pasted in the e-mail? Giovanni On 5 Mar 2018, at 16:25, Amin Mirzai <[email protected]<mailto:[email protected]>> wrote: i tried it.. I even tried it on different machines with different names, with both serial and parallel commands but still the same error appears !!! Thanks anyway, Amin ________________________________ From: users <[email protected]<mailto:[email protected]>> on behalf of Paolo Giannozzi <[email protected]<mailto:[email protected]>> Sent: Monday, March 5, 2018 4:03:13 PM To: Quantum Espresso users Forum Subject: Re: [QE-users] band_structure_calculation There is nothing apparently wrong in your data. Try to remove one by one the variables. If running in parallel, try to run on a single processor. Try "bands.x -in file-name" Paolo On Mon, Mar 5, 2018 at 3:47 PM, Amin Mirzai <[email protected]<mailto:[email protected]>> wrote: Dear QE users, Does anybody have any idea regarding following error: %%%%%%%%%%%%% Error in routine bands (1): reading bands namelist %%%%%%%%%%%%%% This error occurs while I try to plot band structure of the chosen material. All other calculations (scf and nscf) perform correctly. However, when it comes to bands.x calculation, it fails. here is the input file for the bands.x: &BANDS prefix = "eu", outdir = './out', lsym = .true., filband = 'eu.dat' / With kind regards, Amin Mirzai, PhD candidate Dept. of Maskinteknologi, Lund University, P.O. Box 118, SE-221 00 Lund, Sweden _______________________________________________ users mailing list [email protected]<mailto:[email protected]> https://lists.quantum-espresso.org/mailman/listinfo/users -- Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222 _______________________________________________ users mailing list [email protected]<mailto:[email protected]> https://lists.quantum-espresso.org/mailman/listinfo/users -- Giovanni Cantele, PhD CNR-SPIN c/o Dipartimento di Fisica Universita' di Napoli "Federico II" Complesso Universitario M. S. Angelo - Ed. 6 Via Cintia, I-80126, Napoli, Italy e-mail: [email protected]<mailto:[email protected]> Phone: +39 081 676910 Skype contact: giocan74 ResearcherID: http://www.researcherid.com/rid/A-1951-2009 Web page: http://people.fisica.unina.it/~cantele
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