[Pw_forum] Bulk Modulus

Nicola Marzari nicola.marzari at epfl.ch
Tue Jul 19 15:46:33 CEST 2016


On 19/07/2016 15:30, Mofrad, Amir Mehdi (MU-Student) wrote:
> Dear all,
>
>
> I was wondering if someone could show the procedure of calculating the
> bulk modulus for a material in Quantum Espresso (for instance zeolite).
>
>
> Best,
>
>

Hi Amir,


what about google? E.g.

http://146.141.41.27/Tutorials/day3-QE-I.pdf
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Prof Nicola Marzari, Chair of Theory and Simulation of Materials, EPFL
Director, National Centre for Competence in Research NCCR MARVEL, EPFL
http://theossrv1.epfl.ch/Main/Contact http://nccr-marvel.ch/en/project



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