[Wien] ELNES input files
Peter Blaha
pblaha at zeus.theochem.tuwien.ac.at
Wed Nov 24 08:41:32 CET 2004
Look into $WIENROOT/SRC_templates/case.in*
> Here is a basic question about the ELNES calculation. How to generate the
> input files such as case.innes? I cannot find it after running scf cycles.
> This is also a problem for the case.inxs in XSPEC calculation. Is it
> caused because I did all the previous work in parallel execution? If so,
> is there a way to generate those files based on the parallel results?
> Thanks a lot
>
> Shu Miao
>
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>
P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
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