42 lines
1.4 KiB
C++
42 lines
1.4 KiB
C++
/* ----------------------------------------------------------------------
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LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
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http://lammps.sandia.gov, Sandia National Laboratories
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Steve Plimpton, sjplimp@sandia.gov
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Copyright (2003) Sandia Corporation. Under the terms of Contract
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DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
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certain rights in this software. This software is distributed under
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the GNU General Public License.
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See the README file in the top-level LAMMPS directory.
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------------------------------------------------------------------------- */
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#ifndef TEST_EXAMPLE_MELT__H
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#define TEST_EXAMPLE_MELT__H
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#include "../core.h"
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class MeltTest : public LAMMPSTest {
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protected:
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virtual void InitSystem() override {
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command("units lj");
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command("atom_style atomic");
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command("atom_modify map yes");
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command("lattice fcc 0.8442");
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command("region box block 0 2 0 2 0 2");
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command("create_box 1 box");
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command("create_atoms 1 box");
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command("mass 1 1.0");
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command("velocity all create 3.0 87287");
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command("pair_style lj/cut 2.5");
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command("pair_coeff 1 1 1.0 1.0 2.5");
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command("neighbor 0.3 bin");
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command("neigh_modify every 20 delay 0 check no");
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}
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};
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#endif
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