On Sat, Jul 11, 2015 at 6:35 AM, Ka Yi Tsang <[email protected]> wrote:
> > *Error in routine pw_readfile (1): error opening xml data file* > > My files: > [...] > calculation='bands' , > you need to perform a self-consistent calculation before computing bands Paolo -- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, 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
