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Re: [lammps-users] Including b3 structure in meam potential
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Re: [lammps-users] Including b3 structure in meam potential

From: Axel Kohlmeyer <akohlmey@...24...>
Date: Sun, 22 Apr 2018 03:36:57 -0400

On Sat, Apr 21, 2018 at 9:22 AM, Digvijay Yadav <yadavdg3@...24...> wrote:
> Dear all,
>             I am getting error
> ERROR: Unrecognized lattice type in MEAM file 2 (../pair_meam.cpp:712)
> Last command: pair_coeff                 * * library.meam Si C SiC.meam Si C
> actually I want to use the MEAM potential parameter " lattice" as 'b3' (that
> is ZnS structure) in SiC.meam file instead of 'dim', how I can go for it?

does it explicitly say in the manual, that a "b3" lattice option is supported?


> Regards,
> Digvijay
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Dr. Axel Kohlmeyer  akohlmey@...24...
College of Science & Technology, Temple University, Philadelphia PA, USA
International Centre for Theoretical Physics, Trieste. Italy.