On Aug 26, 2011, at 6:08 , Tram Bui wrote: > In DOS calculation, one will obtain a Fermi energy value. And my > guess is > that it is taken with respect to the bottom of the valence band.
the Fermi energy is taken on the same energy scale as for Kohn-Sham eigenvalues 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
