On Jul 2, 2011, at 3:10 , WANG Wei wrote: > However, I set input_dft = 'vdw1', I got the
'vdw1' /= 'vdw-DF', as explained in the documentation and reprinted in the output. The correct name is 'vdw-DF'. 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