[Pw_forum] Access Charge Value

[Lorenzo Paulatto]

No, this quantity does not exist in plane waves simulations. But you can
use projwfc.x to have one of the many possible definitions.

Hth

-- 
Lorenzo Paulatto
Written on a virtual keyboard with real fingers

On 27 Jul 2017 8:23 a.m., "Rajesh" <creativeidleminds at gmail.com> wrote:

> Dear users
> How can I access value of charge on individual atoms in a system with
> ionic bond character from the pw.x output files?
>
>
> Thanks.
> Rajesh
>
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