[gmx-users] lennard-jones 9-3 wall ( Gromacs & LAMMPS )

[Mark Abraham]

Hi,

I would start with the lammps documentation and find out what their wall
implements.

Mark

On Mon, 14 Nov 2016 07:53 SaeeD PourasaD <saeedpourasad at gmail.com> wrote:

> Dear Gromacs users ,
>
> ​I have a question about Lj Wall 9-3 in Gromacs and LAMMPS !
> ​in Gromacs this is the definition of wall : L J integrated over the volume
> behind the wall: 9-3 potential .
> In LAMMPS there is no any special definition for that .
> Can you please let me know what the difference is between these two walls
> in Gromacs and LAMMPS ?
>
> Regards,
> Saeed.
>
> --
> *Saeed Pourasad*
> PhD Student
> CSM Group
> Ulsan National Institute of Science and Technology ( UNIST )
> Phone : +82-52-217-5629
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