[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
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>



-- 
*Dr. Siddheshwar chopra,*


*M.Sc., Ph.D (Physics)Assistant Professor (Physics),*
*Amity University, Noida, India.*
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20140723/f048efd5/attachment.html>


More information about the users mailing list