[Pw_forum] Symmetries and Pseudopotentials

Paolo Giannozzi giannozz at democritos.it
Mon Jan 31 16:52:03 CET 2011


Daniel Cellucci wrote:

> warning: symmetry operation #  N not allowed.   fractional translation:
>        0.5000000 -0.5000000  0.5000000  in crystal coordinates

http://www.quantum-espresso.org/user_guide/node50.html#SECTION0001110200000000000000

P.
-- 
Paolo Giannozzi, Democritos and University of Udine, Italy



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