[Pw_forum] one question
Altaf Ur Rahman
altafqau1 at gmail.com
Tue May 10 17:58:13 CEST 2016
It is interesting
Bundles of thanks
Best Regards
Altaf Ur Rahman
PhD Student
Computational Condensed Matter Physics
Quaid-i-Azam University Islamabad
Pakistan
On Tue, May 10, 2016 at 2:39 PM, Giovanni Cantele <
giovanni.cantele at spin.cnr.it> wrote:
>
> On 10 May 2016, at 12:32, Altaf Ur Rahman <altafqau1 at gmail.com> wrote:
>
> Hello every one
>
> I want to find thermoelectric properties using Quantum Espresso 5.3.0.
> How to do it?
>
> Thanks in advance
>
> Regards
> Altaf Ur Rahman
> PhD Student
> Computational Condensed Matter Physics
> Quaid-i-Azam University Islamabad
> Pakistan
>
>
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>
>
> have a look to this paper:
> G. Pizzi, D. Volja, B. Kozinsky, M. Fornari, and N. Marzari,
>
> BoltzWann: A code for the evaluation of thermoelectric and electronic
> transport properties with a maximally-localized Wannier functions basis,
> Comp. Phys. Comm. 185, 422 (2014), DOI:10.1016/j.cpc.2013.09.015.
>
>
> The code is included into the Wannier90 package, that is interfaced with
> Quantum-Espresso and is freely available at www.wannier.org
> <http://www.wannier90.org>
>
> Giovanni
>
>
> --
>
> Giovanni Cantele, PhD
> CNR-SPIN
> c/o Dipartimento di Fisica
> Universita' di Napoli "Federico II"
> Complesso Universitario M. S. Angelo - Ed. 6
> Via Cintia, I-80126, Napoli, Italy
> e-mail: giovanni.cantele at spin.cnr.it
> Phone: +39 081 676910
> Skype contact: giocan74
>
> ResearcherID: http://www.researcherid.com/rid/A-1951-2009
> Web page: http://people.na.infn.it/~cantele
>
>
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