[Octopus-users] user_defined species

David Strubbe dstrubbe at berkeley.edu
Wed Apr 28 20:09:47 WEST 2010


Eylul,

As far as I know this is not implemented in the code, although it seems like
a good idea for the future.

David

On Wed, Apr 28, 2010 at 6:02 AM, Eylul Bulut <eylulbulut07 at gmail.com> wrote:

> Dear All,
>
> I'm new to octopus and have been playing around with it on the ground state
> DFT
> calculation of 2D quantum dot (sphererical/rectangular shaped) systems.
> I want to define Specie with user defined potential where the external
> potential would be
> read from a file.
> Can anybody tell me how should be the structure/type of the Vext_file and
> how to read it from inp file?
>
> Thanks in advance.
> Eylul
>
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>
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