forked from lijiext/lammps
41 lines
1.1 KiB
C++
41 lines
1.1 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 LMP_FIX_NH_ASPHERE_H
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#define LMP_FIX_NH_ASPHERE_H
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#include "fix_nh.h"
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namespace LAMMPS_NS {
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class FixNHAsphere : public FixNH {
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public:
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FixNHAsphere(class LAMMPS *, int, char **);
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virtual ~FixNHAsphere();
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void init();
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protected:
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double dtq;
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double **inertia;
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void richardson(double *, double *, double *);
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void omega_from_mq(double *, double *, double *, double *);
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void calculate_inertia();
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void nve_v();
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void nh_v_temp();
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};
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}
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#endif
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