58 lines
1.3 KiB
C++
58 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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#ifndef LMP_FIX_NH_SPHERE_H
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#define LMP_FIX_NH_SPHERE_H
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#include "fix_nh.h"
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namespace LAMMPS_NS {
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class FixNHSphere : public FixNH {
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public:
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FixNHSphere(class LAMMPS *, int, char **);
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void init() override;
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protected:
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double inertia;
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void nve_v() override;
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void nve_x() override;
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void nh_v_temp() override;
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};
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} // namespace LAMMPS_NS
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#endif
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/* ERROR/WARNING messages:
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E: Fix nvt/nph/npt sphere requires atom style sphere
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Self-explanatory.
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E: Fix nvt/nph/npt sphere disc option requires 2d simulation
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UNDOCUMENTED
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E: Fix nvt/npt/nph/sphere require extended particles
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UNDOCUMENTED
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U: Fix nvt/sphere requires extended particles
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This fix can only be used for particles of a finite size.
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*/
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