Loading src/CLASS2/pair_lj_class2_coul_long.h +14 −1 Original line number Diff line number Diff line Loading @@ -2,10 +2,12 @@ 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. ------------------------------------------------------------------------- */ Loading @@ -29,7 +31,7 @@ class PairLJClass2CoulLong : public Pair { virtual void compute(int, int); virtual void settings(int, char **); void coeff(int, char **); void init_style(); virtual void init_style(); virtual double init_one(int, int); void write_restart(FILE *); void read_restart(FILE *); Loading Loading @@ -62,17 +64,28 @@ class PairLJClass2CoulLong : public Pair { #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: Incorrect args for pair coefficients Self-explanatory. Check the input script or data file. E: Pair style lj/class2/coul/long requires atom attribute q The atom style defined does not have this attribute. E: Pair style requires a KSpace style No kspace style is defined. E: Pair cutoff < Respa interior cutoff One or more pairwise cutoffs are too short to use with the specified rRESPA cutoffs. */ Loading
src/CLASS2/pair_lj_class2_coul_long.h +14 −1 Original line number Diff line number Diff line Loading @@ -2,10 +2,12 @@ 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. ------------------------------------------------------------------------- */ Loading @@ -29,7 +31,7 @@ class PairLJClass2CoulLong : public Pair { virtual void compute(int, int); virtual void settings(int, char **); void coeff(int, char **); void init_style(); virtual void init_style(); virtual double init_one(int, int); void write_restart(FILE *); void read_restart(FILE *); Loading Loading @@ -62,17 +64,28 @@ class PairLJClass2CoulLong : public Pair { #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: Incorrect args for pair coefficients Self-explanatory. Check the input script or data file. E: Pair style lj/class2/coul/long requires atom attribute q The atom style defined does not have this attribute. E: Pair style requires a KSpace style No kspace style is defined. E: Pair cutoff < Respa interior cutoff One or more pairwise cutoffs are too short to use with the specified rRESPA cutoffs. */
