On Oct 18, 2011, at 17:27 , ?ric Germaneau wrote: > > FROM IOTK LIBRARY, VERSION 1.2.0 [..] > What does that means?
it means that your compiler is buggy (and this must be the 36000th times I say this) > with ifort it's even scf calculation fails. with recent versions of ifort everything works --- Paolo Giannozzi, Dept of Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
