49 lines
1.3 KiB
C++
49 lines
1.3 KiB
C++
/* -*- c++ -*- ----------------------------------------------------------
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LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
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https://www.lammps.org/, 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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#ifdef COMMAND_CLASS
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// clang-format off
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CommandStyle(create_bonds,CreateBonds);
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// clang-format on
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#else
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#ifndef LMP_CREATE_BONDS_H
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#define LMP_CREATE_BONDS_H
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#include "command.h"
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namespace LAMMPS_NS {
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class CreateBonds : public Command {
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public:
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CreateBonds(class LAMMPS *);
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void command(int, char **) override;
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private:
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int igroup, group1bit, group2bit;
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int btype, atype, dtype;
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tagint batom1, batom2, aatom1, aatom2, aatom3, datom1, datom2, datom3, datom4;
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double rmin, rmax;
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void many();
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void single_bond();
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void single_angle();
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void single_dihedral();
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void single_improper();
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};
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} // namespace LAMMPS_NS
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#endif
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#endif
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