[DFTB-Plus-User] DFTB+ 22.2 released
Amritpal ghumman
amritpalghumman at gmail.com
Wed Jan 18 15:57:29 CET 2023
Hi
I need to calculate Raman Spectra using DFTB+ 22.2. Please give your
valuable suggestion how to do the same.
With Best Regards
Amritpal Singh
On Tue, Dec 20, 2022 at 7:59 PM Bálint Aradi <aradi at uni-bremen.de> wrote:
> Dear DFTB+ users,
>
> To conclude the year 2022, we have released DFTB+ version 22.2. It
> contains some small usability improvements, some new features (including
> possibility for calculating Raman activity and IR intensities) and some
> minor bug fixes.
>
> With this end-of-the-year release, we would like to wish you a happy,
> healthy and successful 2023. We hope, that DFTB+ will be helpful for
> your research also next year, and we are looking forward to your
> feedback, suggestions and contributions in 2023.
>
> The DFTB+ developers
>
> --
> 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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>
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