[Pw_forum] kpoints.x querry
Paolo Giannozzi
giannozz at democritos.it
Mon Jan 14 22:10:20 CET 2013
On Jan 11, 2013, at 18:00 , Nandan Tandon wrote:
> 2. A 4x4x4 grid has points like:
>
> 51 -1.2500000 0.2500000 -0.2500000 0.00 7
equivalent to 3/4 1/4 -1/4
> 52 -1.5000000 0.0000000 0.0000000 0.00 6
equivalent to 1/2 0 0
P.
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Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
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