/* -*- c++ -*- ---------------------------------------------------------- LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator http://lammps.sandia.gov, Sandia National Laboratories Steve Plimpton, sjplimp@sandia.gov Copyright (2003) Sandia Corporation. Under the terms of Contract DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains certain rights in this software. This software is distributed under the GNU General Public License. See the README file in the top-level LAMMPS directory. ------------------------------------------------------------------------- */ #ifdef FIX_CLASS FixStyle(nve/cell,FixNVECell) #else #ifndef LMP_FIX_NVE_CELL_H #define LMP_FIX_NVE_CELL_H #include "fix_nve.h" namespace LAMMPS_NS { class FixNVECell : public FixNVE { public: FixNVECell(class LAMMPS *, int, char **); virtual ~FixNVECell() {} void init(); virtual void initial_integrate(int); virtual void final_integrate(); protected: double diffusion_rot; class RanMars *random; }; } #endif #endif /* ERROR/WARNING messages: E: Illegal ... command Self-explanatory. Check the input script syntax and compare to the documentation for the command. You can use -echo screen as a command-line option when running LAMMPS to see the offending line. E: Fix nve/sphere requires atom style sphere Self-explanatory. E: Fix nve/sphere requires atom attribute mu An atom style with this attribute is needed. E: Fix nve/sphere requires extended particles This fix can only be used for particles of a finite size. */