[DFTB-Plus-User] use modes for vibrational frequencies of part of atoms
Hu Shuanglin
hushuanglin at gmail.com
Tue Jul 17 16:40:20 CEST 2012
Dear Bálint,
Thank you!
Best Regards,
Shuanglin Hu
On Tue, Jul 17, 2012 at 10:27 AM, Bálint Aradi
<balint.aradi at bccms.uni-bremen.de> wrote:
> Dear Shuanglin,
>
>> What is the problem in my input? Any comments is welcome.
>
> Unfortunately nothing. ;-) It seems to be a bug in modes. I'll fix
> this. Thanks 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/
>
>
>
> _______________________________________________
> DFTB-Plus-User mailing list
> DFTB-Plus-User at dftb-plus.info
> http://www.dftb-plus.info/mailman/listinfo/dftb-plus-user
>
More information about the DFTB-Plus-User
mailing list