>From Doc/release-notes file: --- Incompatible changes in version 6.4 version: [...] * Old format (-D__OLDXML) deleted. Everything should work as before but some exotic options might have problems. The following utilities no longer work: - cppp.x (was reading old format only) - importexport.x (superseded by hdf5 for portable binaries) - bgw2pw.x (was writing old format only) --- v.6.3 works only if you use the old XML format
Paolo On Mon, Mar 18, 2019 at 6:02 PM Muhydeen Olakunle Adelani < mo.adel...@gmail.com> wrote: > Dear QE User, > > I am getting an error while post processing using cppp.x in qe-6.3 and qe-6.4 > > task # 19 > from cppp : error # 1 > Cannot open file .//cp_51.save//data-file.xml > So I searched in the QE forum about this and found out that Paolo has already > given a solution for this in the following post dated 2008. > > http://www.democritos.it/pipermail/pw_forum/2008-May/009022.html > > I don't know why the code stick to the default value of ndr(51) instead of > using the one generated from the previous run. > > I attached my input file.Please help me on this. > > &INPUTPP > prefix = 'FG12, > fileout = 'postproc', > outdir = './tmp/', > output = 'xsf', > ndr = 94, > charge =.false., > atomic_number(1)=26, > atomic_number(2) = 31, > ldynamics =.true., > nframes = 200, > / > Greeting. > > PhD Student > Centro de Investigacion en Materiales Avanzados,S.C. > Mexico. > _______________________________________________ > users mailing list > users@lists.quantum-espresso.org > 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
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