On Fri, 2014-09-05 at 17:11 -0700, Hans Horn wrote: > is there a way to convert a 'PRIMVEC' block (from xcrysden) > into 'celldm' as understood by QE ?
I guess it is easier to convert the PRIMVEC block into the CELL_PARAMETERS card P. -- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
