On Apr 14, 2011, at 12:39 PM, Giuseppe Mattioli wrote: > > Dear Jiayu > Yes, it is. You can perform TDDFPT calculations by using the gamma point, > nspin=1 and fixed occupations (no smearing). There are no theoretical > limitations regarding k-points, but they are currently not implemented.
they will SB --- Stefano Baroni - SISSA & DEMOCRITOS National Simulation Center - Trieste http://stefano.baroni.me [+39] 040 3787 406 (tel) -528 (fax) / stefanobaroni (skype) La morale est une logique de l'action comme la logique est une morale de la pens?e - Jean Piaget Please, if possible, don't send me MS Word or PowerPoint attachments Why? See: http://www.gnu.org/philosophy/no-word-attachments.html -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110418/f1c62ca5/attachment.htm
