On Feb 2, 2012, at 20:48 , Vikas Varshney wrote: > For the next q point, I do not get convergence try first of all to reduce alpha_mix P. --- Paolo Giannozzi, Dept of Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222