In data 30 settembre 2010 alle ore 15:30:01, Elie Moujaes <elie.moujaes at hotmail.co.uk> ha scritto: > The thing is there are no problems in the DOS calculations; only in the > band structure.
Are you sure you did a proper band plot along a path in the Brillouin zone (like example01) and not just plot of the band energies of the regular grid of k-points? regards -- Lorenzo Paulatto post-doc @ IMPMC/UPMC - Universit? Paris 6 phone: +33 (0)1 44 27 74 89 www: http://www-int.impmc.upmc.fr/~paulatto/ previously (take note of the change!): phd student @ SISSA & DEMOCRITOS (Trieste) phone: +39 040 3787 511 www: http://people.sissa.it/~paulatto/
