[Pw_forum] IS DUAL CORE 2.7 GHz, 2GB RAM SUFFICIENT FOR QE calculations??

[ashkan shekaari]

dear Siddheshwar chopra

i suggest wien2k only for optical properties .

unfortunately , i have no information about any software for magnetic
properties of molecules .

best regards.

On 7/23/14, siddheshwar chopra <sidhusai at gmail.com> wrote:
> 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.*
>


-- 
Best wishes
Ashkan Shekaari