[Wien] The description of case.energy
Peter Blaha
pblaha at theochem.tuwien.ac.at
Mon Dec 14 07:46:53 CET 2009
This file is so DIFFICULT, that a description is not really needed.
Compare this file with case.output1 and "guess" what these numbers could be
(in particular when the name of the file is "case.energy".
155220089 schrieb:
> Dear all,
>
>
>
> I want to learn detail information about the output file case.energy.
> But I can't find it in the wien2k usersguide.
>
> Can anybody give me a detail description of case.energy like the example
> of case.struct in the usersguide.
>
>
>
>
>
>
>
>
>
> Best wishes!
>
> An zhou
>
>
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--
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Peter Blaha
Inst. Materials Chemistry, TU Vienna
Getreidemarkt 9, A-1060 Vienna, Austria
Tel: +43-1-5880115671
Fax: +43-1-5880115698
email: pblaha at theochem.tuwien.ac.at
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