The error message you report does not comtain the most informative part. Anyway: at line 119 of file */plot_io.f90 likely there is a "read" instruction that doesn't find what it expects. Try to figure out why.
Paolo On Tue, Aug 2, 2016 at 12:24 AM, Ozan Dernek <[email protected]> wrote: > Hello, > > I would like to run a charge difference calculation but the calculation > fails. I am using the input file as given below: > > &inputpp > / > &plot > nfile=3, > filepp(1)="charge.whole", > filepp(2)="charge.surf", > filepp(3)="charge.mol", > weight(1)=1, > weight(2)=-1, > weight(3)=-1, > iflag=3, > output_format=5, > fileout="eth_bind_au_ni.xsf" > / > > > It gives an error file as: > > Image PC Routine Line Source > pp.x 00000000009685B7 Unknown Unknown Unknown > pp.x 00000000009661D7 Unknown Unknown Unknown > pp.x 000000000088316E read_io_header_ 119 > plot_io.f90 > pp.x 000000000040C584 chdens_ 236 > chdens.f90 > pp.x 0000000000406463 MAIN__ 44 > postproc.f90 > pp.x 0000000000405CB6 Unknown Unknown Unknown > libc.so.6 00000039D281D994 Unknown Unknown Unknown > pp.x 0000000000405BB9 Unknown Unknown Unknown > > > > I have checked the charge files and did not recognize any problem. I have > tried Quantum Espresso version 5.1 and 5.3.0. Both produce the same error > file. How can i get rid of this problem ? > > Regards, > > Ozan Dernek, > Msc. Student > Middle East Technical Univesity, Turkey > > _______________________________________________ > Pw_forum mailing list > [email protected] > http://pwscf.org/mailman/listinfo/pw_forum -- 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 _______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
