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This repository has been archived by the owner on Oct 6, 2021. It is now read-only.

Test cases for dttd4_vasp #5

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jjlow opened this issue Sep 30, 2021 · 1 comment
Open

Test cases for dttd4_vasp #5

jjlow opened this issue Sep 30, 2021 · 1 comment

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@jjlow
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jjlow commented Sep 30, 2021

I have succeeded in building vasp 6.2.1 with the dftd4 library. It would be nice to have a few test dftd4 calculations to be sure everything is being done correctly in my build. Could the dftd4 developers provide a few examples of dftd4_vasp calculations?

Thanks,

John Low
Argonne National Laboratory.

@awvwgk
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awvwgk commented Oct 4, 2021

This repository is not maintained anymore by its original author and out-dated with respect to the Vasp integration of dftd4.

Cross-posted at dftd4/dftd4#130

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