If it is a very old version, you may have to use &input instead of &bands
-- Lorenzo Paulatto Written on a virtual keyboard with real fingers On Mon, Mar 5, 2018, 16:57 Amin Mirzai <[email protected]> wrote: > 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]> 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]> on behalf of > Paolo Giannozzi <[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]> > 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] >> 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] > 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] <[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 > > _______________________________________________ > users mailing list > [email protected] > https://lists.quantum-espresso.org/mailman/listinfo/users
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