[Pw_forum] number of k-point

Dear Davoud Use K_POINTS {automatic} 4, 4, 4, 1, 1, 1 for a grid of, e.g., 4*4*4 k points (shifted wrt gamma, this is the meaning of the 1,1,1 cards). If you want to include gamma, your six numbers will be 4, 4, 4, 0, 0, 0. Notice that the generated k-points could be replicated (or deleted) d

[Pw_forum] Orthorhombic

e cubic, FCC or hexagonal do not encounter the above error. Any suggestions? Thanking you, Suza W. Student RRI Bangalore -- next part -- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20100529/ce3db4ab/attachment.htm

[Pw_forum] number of k-point

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