[Pw_forum] LDA pseudo for F
Juan Manuel Lopez
juanlopez415 at gmail.com
Tue Jun 9 22:32:45 CEST 2009
Dear PWSCF users,
Some body can help me about to make a good input (scf.in) for a supercell
with around 100 atoms, including Cobalt and Organic molecules. Because I
try with the example input, but does not converge.
--
Best regards,
--------------------------------------
Juan M. Lopez Encarnacion
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/pw_forum/attachments/20090609/f93f6437/attachment.htm
More information about the Pw_forum
mailing list