[QE-users] Issue in WAN90_example

Paolo Giannozzi p.giannozzi at gmail.com
Wed Sep 9 17:16:15 CEST 2020


Wannier90 must be compiled ("make w90" should do the job), the
"run_example" script may need to be updated (it was written for a very old
version of the code), and the link from "qe-6.5/bin/wannier90.x" to the
executable must be in place

Paolo

On Wed, Sep 9, 2020 at 10:23 AM Poonam Kaushik <poonamkaushik40 at gmail.com>
wrote:

> Dear All,
> I'm trying to replicate the results of WAN90_example in the reference
> /user/qe-6.5/PP/examples/WAN90_example. While I successfully completed scf
> and nscf calculations, I am facing the issue, during the run of
> $WAN_COMMAND -pp diamond.sa, and indeed there is no directory in the bin
> wannier90.x.
> "/user/qe-6.5/bin/wannier90.x' not existent or not executable".
> Can anyone please help to figure out this issue?  I'll very thankful for
> any help.
>
> Thanks and regards,
> Poonam Sharma
>
> -------------------------------------------------------------------------------------------------
> Poonam Sharma
> Research Scholar
> Department of Physics
> Indian Institute of Technology Bombay
> Mumbai - 400076
> India.
>
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-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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