Thank you very much. It is quite helpfull. 2016-02-02 22:48 GMT+02:00 Paolo Giannozzi <[email protected]>:
> Well, no, line 412 and following (noncolinear/spinorbit case); line 161 > and following is the standard case, in which it is unlikely to have more > than 10 atomic wavefunctions > > Paolo > > On Tue, Feb 2, 2016 at 9:40 PM, Paolo Giannozzi <[email protected]> > wrote: > >> On Tue, Feb 2, 2016 at 1:11 PM, Hüseyin Yasin Uzunok < >> [email protected]> wrote: >> >>> from partialdos_nc : error # 31 >>> file extension not supporting so many atomic wfc >>> >>> I guess that the problem is upcoming from the number of allowed wfc >>> >> >> no, it is a rather dumb problem with file names and formats. You have to >> modify this part (line 161 and following in PP/src/partialdos.f90): >> WRITE (filextension(c_tab:),'(")_wfc#",i1,"(",a1,")")') & >> nlmchi(nwfc)%n, l_label(nlmchi(nwfc)%l) >> to account for the case nlmchi(nwfc)%n > 9 (note the format i1) >> >> Paolo >> -- >> 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 >> >> > > > -- > 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 > -- ----------------------------------------------------------- *Arş. Gör. H. Yasin UZUNOK* *Sakarya Üniversitesi Fizik Bölümü* *tel:0.264.295 6192* --------------------------------------------------
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