[ase-users] neb calculation with ASE + PWSCF
Otto Kohulák
pravod at gmail.com
Thu Mar 3 17:37:40 CET 2016
Hello Elham,
I did some NEB calculations via ASE with PWSCF,
what seems to be the problem
Otto Kohulák
2016-03-03 16:40 GMT+01:00 Elham <e.chemistry83 at gmail.com>:
> Dear ASE users,
>
> Any of this group work with nab calculation with ASE and PWSCF?
>
> Thanks so much
>
> Elham Ashuri
> Ph.D. student of Physical Chemistry
> Institute for Advanced Studies in Basic Sciences (IASBS)
>
> IRAN
>
>
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