[Pw_forum] Periodic Boundary Condition in PW

[Rajesh]

Dear Stefano,

Thank you for clarification. What boundary conditions are good for 2D
materials? pbd or bc1?

Thank you.

Rajesh

On Sat, Jul 22, 2017 at 2:16 PM, stefano de gironcoli <degironc at sissa.it>
wrote:

> Dear  Rajesh,
>
> quantum espresso is a periodic code. PBC are the default.
> you'll find options to remove (or account for) interaction with periodic
> replicas.
>
> stefano
>
>
>
> On 22/07/2017 10:34, Rajesh wrote:
>
> Dear users
>
> How can I employ periodic boundary conditions in quamtum espresso?
> I dont find any option in pwgui for pbc.
>
> Thank you.
>
> Rajesh
>
>
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