[Pw_forum] IS DUAL CORE 2.7 GHz, 2GB RAM SUFFICIENT FOR QE calculations??
siddheshwar chopra
sidhusai at gmail.com
Wed Jul 23 12:05:57 CEST 2014
Dear Ashkan,
Yes you are correct. But I want to study magnetic properties. I use FIREFLY
8.1.0. But it doesn't fit for magnetic properties. Could you suggest any
software for studying magnetic properties of molecules?
WIEN2K is very slow I guess.
Regards,
On Wed, Jul 23, 2014 at 2:57 PM, ashkan shekaari <shekaari at gmail.com> wrote:
> Dear Siddheshwar
>
> for dealing with molecules , i suggest gaussian code g09 .
>
> for the optical properties , espresso is very weak and i suggest
> again gaussian g09 or wien2k .
>
> --
> Best wishes
> Ashkan Shekaari
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--
*Dr. Siddheshwar chopra,*
*M.Sc., Ph.D (Physics)Assistant Professor (Physics),*
*Amity University, Noida, India.*
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