forked from lijiext/lammps
127 lines
2.8 KiB
C++
127 lines
2.8 KiB
C++
/* -*- 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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#ifdef COMPUTE_CLASS
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ComputeStyle(slice,ComputeSlice)
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#else
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#ifndef LMP_COMPUTE_SLICE_H
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#define LMP_COMPUTE_SLICE_H
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#include "compute.h"
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namespace LAMMPS_NS {
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class ComputeSlice : public Compute {
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public:
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ComputeSlice(class LAMMPS *, int, char **);
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virtual ~ComputeSlice();
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void init();
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void compute_vector();
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void compute_array();
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private:
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int me;
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int nstart,nstop,nskip,nvalues;
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int *which,*argindex,*value2index;
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char **ids;
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void extract_one(int, double *, int);
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};
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}
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Illegal ... command
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Self-explanatory. Check the input script syntax and compare to the
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documentation for the command. You can use -echo screen as a
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command-line option when running LAMMPS to see the offending line.
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E: Compute ID for compute slice does not exist
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Self-explanatory.
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E: Compute slice compute does not calculate a global array
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Self-explanatory.
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E: Compute slice compute vector is accessed out-of-range
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The index for the vector is out of bounds.
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E: Compute slice compute does not calculate a global vector
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Self-explanatory.
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E: Compute slice compute array is accessed out-of-range
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An index for the array is out of bounds.
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E: Compute slice compute does not calculate global vector or array
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Self-explanatory.
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E: Fix ID for compute slice does not exist
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Self-explanatory.
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E: Compute slice fix does not calculate a global array
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Self-explanatory.
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E: Compute slice fix vector is accessed out-of-range
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The index for the vector is out of bounds.
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E: Compute slice fix does not calculate a global vector
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Self-explanatory.
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E: Compute slice fix array is accessed out-of-range
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An index for the array is out of bounds.
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E: Compute slice fix does not calculate global vector or array
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Self-explanatory.
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E: Variable name for compute slice does not exist
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UNDOCUMENTED
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E: Compute slice variable is not vector-style variable
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UNDOCUMENTED
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E: Compute slice vector variable cannot be indexed
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UNDOCUMENTED
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E: Fix used in compute slice not computed at compatible time
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Fixes generate their values on specific timesteps. Compute slice is
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requesting a value on a non-allowed timestep.
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E: Compute slice variable is not long enough
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UNDOCUMENTED
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*/
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