/* ---------------------------------------------------------------------- LIGGGHTS - LAMMPS Improved for General Granular and Granular Heat Transfer Simulations LIGGGHTS is part of the CFDEMproject www.liggghts.com | www.cfdem.com This file was modified with respect to the release in LAMMPS Modifications are Copyright 2009-2012 JKU Linz Copyright 2012-2014 DCS Computing GmbH, Linz Copyright 2015- JKU Linz 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 directory. ------------------------------------------------------------------------- */ #ifdef COMPUTE_CLASS ComputeStyle(neighbor/atom,ComputeNeighborAtom) #else #ifndef LMP_COMPUTE_NEIGHBOR_ATOM_H #define LMP_COMPUTE_NEIGHBOR_ATOM_H #include "compute.h" namespace LAMMPS_NS { class ComputeNeighborAtom : public Compute { public: ComputeNeighborAtom(class LAMMPS *, int, char **); ~ComputeNeighborAtom(); virtual void init(); void init_list(int, class NeighList *); virtual void compute_peratom(); int pack_reverse_comm(int, int, double *); void unpack_reverse_comm(int, int *, double *); double memory_usage(); protected: int nmax; class NeighList *list; double * neighs; }; } #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: Compute neighbor/atom requires atom style sphere Self-explanatory. E: Compute neighbor/atom requires a pair style be defined Self-explantory. W: More than one compute neighbor/atom It is not efficient to use compute neighbor/atom more than once. */