[gpaw-users] all-electron setups

Torsten Hahn Torsten.Hahn at physik.tu-freiberg.de
Fri Dec 2 14:20:10 CET 2011


Hi all,

iam a bit confused and all the Docu doesn't helps. How can i generate / use an all-electron setup?

Doing

gpaw-setup -f PBE H -a

does not generate an xml-file, like in the case of "normal" paw setups. So how is this to be done?

Best regards,
Torsten. 





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