LAMMPS WWW Site - LAMMPS Documentation - LAMMPS Mailing List Archives
Re: [lammps-users] hybrid pair_style error
[Date Prev][Date Next][Thread Prev][Thread Next][Date Index][Thread Index]

Re: [lammps-users] hybrid pair_style error


From: Axel Kohlmeyer <akohlmey@...24...>
Date: Mon, 6 Nov 2017 23:28:41 -0500



On Mon, Nov 6, 2017 at 10:02 PM, YOHANNA Jacob Baro via lammps-users <lammps-users@lists.sourceforge.net> wrote:
Hi,
I got this error when running mysimulation. can somebody help please?

​there are about 5 definite errors in this little input segment​, and likely a couple more conceptual problems which point to a significant lack of experience and understanding.
i suggest you start with something simpler, where you don't need to use anything "hybrid".

since LAMMPS is a modular software, you need to make certain, that you have all modules included, that are needed for your simulations. it appears, that this is not the case here.

axel.
 

    ERROR: Illegal pair_style command (../pair_lj_cut.cpp:430)
    Last command: pair_style hybrid lj/cut 2.5 sw tersoff

here is part of my input file.

pair_style hybrid lj/cut 2.5 sw tersoff
pair_coeff       * * Ge.tersoff Ge
pair_coeff       * * p.sw P
pair_coeff       1 2 lj/cut 1.0 1.0 2.5

Jakes



------------------------------------------------------------------------------
Check out the vibrant tech community on one of the world's most
engaging tech sites, Slashdot.org! http://sdm.link/slashdot
_______________________________________________
lammps-users mailing list
lammps-users@...6297....sourceforge.net
https://lists.sourceforge.net/lists/listinfo/lammps-users




--
Dr. Axel Kohlmeyer  akohlmey@...12...24...  http://goo.gl/1wk0
College of Science & Technology, Temple University, Philadelphia PA, USA
International Centre for Theoretical Physics, Trieste. Italy.