[Pw_forum] k-points sample in BZ

[Paolo Giannozzi]

On Friday 07 April 2006 15:41, lan haiping wrote:

>   I do not understand clearly about the k-grid offset 
>   in automatic scheme(M-P grid). 
>
>  Would anyone give me some hints or reference related
>  to this problem? 

you may try this one: P. E. Bloechl et al, PRB49, 16223 (1994)

Paolo
-- 
Paolo Giannozzi             e-mail:  giannozz at nest.sns.it
Scuola Normale Superiore    Phone:   +39/050-509876, Fax:-563513 
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