On Mar 23, 2011, at 13:04 , ANUP THOMAS wrote: > I, Anup Thomas, a novice in this field of solid state structure > simulation.
novices should first of all read some literature introducing to the subject. > I would like to perform band structure calculations for some > organic crystals. > see the discussion on van der Waals bonded systems. 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