/* -*- 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(balance,FixBalance) #else #ifndef LMP_FIX_BALANCE_H #define LMP_FIX_BALANCE_H #include #include "fix.h" namespace LAMMPS_NS { class FixBalance : public Fix { public: FixBalance(class LAMMPS *, int, char **); ~FixBalance(); int setmask(); void post_constructor(); void init(); void setup(int); void setup_pre_exchange(); void pre_exchange(); void pre_neighbor(); double compute_scalar(); double compute_vector(int); double memory_usage(); private: int nevery,lbstyle,nitermax; double thresh,stopthresh; char bstr[4]; int wtflag; // 1 for weighted balancing double imbnow; // current imbalance factor double imbprev; // imbalance factor before last rebalancing double imbfinal; // imbalance factor after last rebalancing double maxloadperproc; // max load on any processor int itercount; // iteration count of last call to Balance int kspace_flag; // 1 if KSpace solver defined int pending; bigint lastbalance; // last timestep balancing was attempted class Balance *balance; class Irregular *irregular; void rebalance(); }; } #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 balance shift string is invalid The string can only contain the characters "x", "y", or "z". E: Fix balance rcb cannot be used with comm_style brick Comm_style tiled must be used instead. E: Fix balance nevery = 0 cannot be used with weight var UNDOCUMENTED U: Cannot open fix balance output file Self-explanatory. */