Re: [SIESTA-L] mobility, effective mass etc..

[I. Camps]

Also for thermal related calculations you can take a look at for Phono3py:

http://atztogo.github.io/phono3py/

Also this software calculate the Joint density of states (JDOS) (that you
ask in previous message).


[]'s,

Camps

On Sun, Oct 2, 2016 at 9:22 AM, Suman Chowdhury 
wrote:

> Dear SIESTA use,
> Does anyone know how to calculate effective mass, mobility, thermal and
> electrical conductivity, Seebeck coefficient through siesta simulation???
>
> --
>
>
>
> *Senior research fellow Dept. of Physics, University of Calcutta Kolkata-
> 79, West Bengal, India.*
> * Ph no-+91-9830512232 <%2B91-9830512232>*
>
>

Re: [SIESTA-L] mobility, effective mass etc..

[I. Camps]

Please Mostafa,

Create your own threat, do not reuse questions from other users!


[]'s,

Camps

On Sun, Oct 2, 2016 at 5:39 PM, Mostafa Shabani <
mostafa.nanophys...@gmail.com> wrote:

> Dear siesta user,
> I have same questions about some transistors key parameters: (ON/OFF
> ratio, transconductance, mobility, subthreshold swing)
> I want to know how we can calculate this parameters? Is it possible to
> calculate them with siesta/transiesta package?
>
> Best regards
>
>
>
> On Sun, Oct 2, 2016 at 3:52 PM, Suman Chowdhury <
> sumanchowdhur...@gmail.com> wrote:
>
>> Dear SIESTA use,
>> Does anyone know how to calculate effective mass, mobility, thermal and
>> electrical conductivity, Seebeck coefficient through siesta simulation???
>>
>> --
>>
>>
>>
>> *Senior research fellow Dept. of Physics, University of Calcutta Kolkata-
>> 79, West Bengal, India.*
>> * Ph no-+91-9830512232 <%2B91-9830512232>*
>>
>>
>

Re: [SIESTA-L] mobility, effective mass etc..

[I. Camps]

Hi,

I found these two codes that can compute the effective masses from XCrysDen
BSXF file format. I am not sure if there is any tools that convert the
SIESTA output files to this formats. The software are:

SKEAF: http://www.wien2k.at/reg_user/unsupported/SKEAFrelease_
v1p3p0_r149.tar.gz
DHVA: https://github.com/danielguterding/dhva



[]'s,

Camps

On Sun, Oct 2, 2016 at 9:22 AM, Suman Chowdhury 
wrote:

> Dear SIESTA use,
> Does anyone know how to calculate effective mass, mobility, thermal and
> electrical conductivity, Seebeck coefficient through siesta simulation???
>
> --
>
>
>
> *Senior research fellow Dept. of Physics, University of Calcutta Kolkata-
> 79, West Bengal, India.*
> * Ph no-+91-9830512232 <%2B91-9830512232>*
>
>

Re: [SIESTA-L] mobility, effective mass etc..

[Mostafa Shabani]

Dear siesta user,
I have same questions about some transistors key parameters: (ON/OFF ratio,
transconductance, mobility, subthreshold swing)
I want to know how we can calculate this parameters? Is it possible to
calculate them with siesta/transiesta package?

Best regards



On Sun, Oct 2, 2016 at 3:52 PM, Suman Chowdhury 
wrote:

> Dear SIESTA use,
> Does anyone know how to calculate effective mass, mobility, thermal and
> electrical conductivity, Seebeck coefficient through siesta simulation???
>
> --
>
>
>
> *Senior research fellow Dept. of Physics, University of Calcutta Kolkata-
> 79, West Bengal, India.*
> * Ph no-+91-9830512232*
>
>

[SIESTA-L] mobility, effective mass etc..

[Suman Chowdhury]

Dear SIESTA use,
Does anyone know how to calculate effective mass, mobility, thermal and
electrical conductivity, Seebeck coefficient through siesta simulation???

-- 



*Senior research fellow Dept. of Physics, University of Calcutta Kolkata-
79, West Bengal, India.*
* Ph no-+91-9830512232*