[DFTB-Plus-User] cubemanip

Sharma SRK Chaitanya Yamijala sharmajncasr at gmail.com
Mon Feb 5 20:58:10 CET 2018


Thanks, Balint.





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SRK *Chaitanya* Sharma, Yamijala.
http://www.bmwong-group.com/group-members/


On Mon, Feb 5, 2018 at 11:42 AM, Bálint Aradi <aradi at uni-bremen.de> wrote:

> Dear Sharma,
>
> > May I know, what was the issue? Is it because of calling oldnumeric?
>
> Yes, you were spotting it correctly. I just removed oldnumeric and
> converted to normal numpy routines instead.
>
> Thanks again for reporting!
>
> Best regards,
>
> Bálint
>
>
> --
> Dr. Bálint Aradi
> Bremen Center for Computational Materials Science, University of Bremen
> http://www.bccms.uni-bremen.de/cms/people/b-aradi/
>
>
>
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