Dear all can somebody tell me how to choose a correct degauss value for an SCF calculation and also the physics behind it.
-- U.Saibabu PhD student, Deformation mechanisms modeling group, Materials engineering department, IISc Bangalore, India. -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20090907/9d8a7005/attachment.htm
