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

SaeeD PourasaD saeedpourasad at gmail.com
Mon Nov 14 07:53:35 CET 2016

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 ?


*Saeed Pourasad*
PhD Student
CSM Group
Ulsan National Institute of Science and Technology ( UNIST )
Phone : +82-52-217-5629

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