[Pw_forum] question about projwfc.x

Paolo Giannozzi giannozz at democritos.it
Mon Apr 19 16:24:50 CEST 2010


Parwana HABIBI wrote:

> I would like to see the different contributions 
> of each orbital listed exactly as this, but for each orbital.

the output file contains the decomposition of each Kohn-Sham
orbital into atomic orbitals

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



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