git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5705 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2011-02-22 22:09:18 +00:00
parent e9f22f70d0
commit d51c47d9ab
101 changed files with 108 additions and 111 deletions

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@ -15,9 +15,9 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_ellipsoid.h"
#include "lmptype.h"
#include "math_extra.h"
#include "atom.h"
#include "force.h"

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@ -15,11 +15,11 @@
Contributing author: Eric Simon (Cray)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "string.h"
#include "stdlib.h"
#include "dihedral_class2.h"
#include "lmptype.h"
#include "atom.h"
#include "neighbor.h"
#include "update.h"

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@ -15,11 +15,11 @@
Contributing author: Eric Simon (Cray)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "string.h"
#include "stdlib.h"
#include "improper_class2.h"
#include "lmptype.h"
#include "atom.h"
#include "neighbor.h"
#include "update.h"

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_colloid.h"
#include "lmptype.h"
#include "atom.h"
#include "force.h"
#include "domain.h"

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_dipole.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -15,11 +15,11 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "pair_cg_cmm_coul_long_gpu.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -15,11 +15,11 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "pair_cg_cmm_gpu.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -15,11 +15,11 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "pair_gayberne_gpu.h"
#include "lmptype.h"
#include "math_extra.h"
#include "atom.h"
#include "atom_vec.h"

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@ -15,11 +15,11 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "pair_lj96_cut_gpu.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -15,11 +15,11 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "pair_lj_charmm_coul_long_gpu.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -15,11 +15,11 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "pair_lj_cut_coul_cut_gpu.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -15,11 +15,11 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "pair_lj_cut_coul_long_gpu.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -15,11 +15,11 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "pair_lj_cut_gpu.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -11,11 +11,11 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "atom_vec_granular.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -15,13 +15,13 @@
Contributing authors: Roy Pollock (LLNL), Paul Crozier (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "string.h"
#include "stdio.h"
#include "stdlib.h"
#include "math.h"
#include "pppm.h"
#include "lmptype.h"
#include "atom.h"
#include "comm.h"
#include "neighbor.h"

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@ -20,8 +20,8 @@ KSpaceStyle(pppm,PPPM)
#ifndef LMP_PPPM_H
#define LMP_PPPM_H
#include "kspace.h"
#include "lmptype.h"
#include "kspace.h"
namespace LAMMPS_NS {

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@ -15,12 +15,12 @@
Contributing author: Tzu-Ray Shan (U Florida, rayshan@ufl.edu)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "fix_qeq_comb.h"
#include "lmptype.h"
#include "atom.h"
#include "force.h"
#include "group.h"

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@ -20,9 +20,9 @@ FixStyle(qeq/comb,FixQEQComb)
#ifndef LMP_FIX_QEQ_COMB_H
#define LMP_FIX_QEQ_COMB_H
#include "lmptype.h"
#include "stdio.h"
#include "fix.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_angle.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_bond.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_full.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_molecular.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "bond_fene.h"
#include "lmptype.h"
#include "atom.h"
#include "neighbor.h"
#include "domain.h"

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "bond_fene_expand.h"
#include "lmptype.h"
#include "atom.h"
#include "neighbor.h"
#include "domain.h"

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@ -15,11 +15,11 @@
Contributing author: Paul Crozier (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "dihedral_charmm.h"
#include "lmptype.h"
#include "atom.h"
#include "comm.h"
#include "neighbor.h"

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@ -15,11 +15,11 @@
Contributing author: Paul Crozier (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "dihedral_harmonic.h"
#include "lmptype.h"
#include "atom.h"
#include "comm.h"
#include "neighbor.h"

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@ -16,11 +16,11 @@
Mark Stevens (Sandia)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "mpi.h"
#include "dihedral_helix.h"
#include "lmptype.h"
#include "atom.h"
#include "neighbor.h"
#include "domain.h"

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@ -15,10 +15,10 @@
Contributing author: Mathias Puetz (SNL) and friends
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "dihedral_multi_harmonic.h"
#include "lmptype.h"
#include "atom.h"
#include "neighbor.h"
#include "domain.h"

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@ -15,10 +15,10 @@
Contributing author: Mark Stevens (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "dihedral_opls.h"
#include "lmptype.h"
#include "atom.h"
#include "comm.h"
#include "neighbor.h"

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@ -11,11 +11,11 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "improper_cvff.h"
#include "lmptype.h"
#include "atom.h"
#include "comm.h"
#include "neighbor.h"

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@ -11,11 +11,11 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "improper_harmonic.h"
#include "lmptype.h"
#include "atom.h"
#include "comm.h"
#include "neighbor.h"

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@ -15,10 +15,10 @@
Contributing author: Mike Parks (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "float.h"
#include "stdlib.h"
#include "atom_vec_peri.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -15,10 +15,10 @@
Contributing author: Aidan Thompson (Sandia)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "fix_reax_bonds.h"
#include "lmptype.h"
#include "pair_reax_fortran.h"
#include "atom.h"
#include "update.h"

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@ -20,9 +20,9 @@ FixStyle(reax/bonds,FixReaxBonds)
#ifndef LMP_FIX_REAX_BONDS_H
#define LMP_FIX_REAX_BONDS_H
#include "lmptype.h"
#include "stdio.h"
#include "fix.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -15,10 +15,10 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "fix_event_prd.h"
#include "lmptype.h"
#include "atom.h"
#include "update.h"
#include "domain.h"

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@ -20,8 +20,8 @@ FixStyle(EVENT/PRD,FixEventPRD)
#ifndef LMP_FIX_EVENT_PRD_H
#define LMP_FIX_EVENT_PRD_H
#include "fix_event.h"
#include "lmptype.h"
#include "fix_event.h"
namespace LAMMPS_NS {

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@ -15,10 +15,10 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "fix_event_tad.h"
#include "lmptype.h"
#include "atom.h"
#include "update.h"
#include "domain.h"

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@ -20,8 +20,8 @@ FixStyle(EVENT/TAD,FixEventTAD)
#ifndef LMP_FIX_EVENT_TAD_H
#define LMP_FIX_EVENT_TAD_H
#include "fix_event.h"
#include "lmptype.h"
#include "fix_event.h"
namespace LAMMPS_NS {

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@ -11,12 +11,12 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "neb.h"
#include "lmptype.h"
#include "universe.h"
#include "atom.h"
#include "update.h"

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@ -15,12 +15,12 @@
Contributing author: Mike Brown (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "prd.h"
#include "lmptype.h"
#include "universe.h"
#include "update.h"
#include "atom.h"

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@ -15,11 +15,11 @@
Contributing author: Mark Sears (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "temper.h"
#include "lmptype.h"
#include "universe.h"
#include "domain.h"
#include "atom.h"

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@ -20,8 +20,8 @@ FixStyle(wall/srd,FixWallSRD)
#ifndef LMP_FIX_WALL_SRD_H
#define LMP_FIX_WALL_SRD_H
#include "fix.h"
#include "lmptype.h"
#include "fix.h"
namespace LAMMPS_NS {

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@ -15,9 +15,9 @@
Contributing author: Andres Jaramillo-Botero (Caltech)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_electron.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -14,8 +14,8 @@
#ifndef LMP_ATOM_H
#define LMP_ATOM_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_atomic.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "atom_vec_charge.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "atom_vec_hybrid.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "modify.h"

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@ -11,12 +11,12 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "stdlib.h"
#include "string.h"
#include "ctype.h"
#include "compute.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "comm.h"

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@ -14,8 +14,8 @@
#ifndef LMP_COMPUTE_H
#define LMP_COMPUTE_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "string.h"
#include "stdlib.h"
#include "compute_reduce.h"
#include "lmptype.h"
#include "atom.h"
#include "update.h"
#include "domain.h"

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@ -20,8 +20,8 @@ ComputeStyle(reduce,ComputeReduce)
#ifndef LMP_COMPUTE_REDUCE_H
#define LMP_COMPUTE_REDUCE_H
#include "compute.h"
#include "lmptype.h"
#include "compute.h"
namespace LAMMPS_NS {

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@ -20,8 +20,8 @@ ComputeStyle(reduce/region,ComputeReduceRegion)
#ifndef LMP_COMPUTE_REDUCE_REGION_H
#define LMP_COMPUTE_REDUCE_REGION_H
#include "compute_reduce.h"
#include "lmptype.h"
#include "compute_reduce.h"
namespace LAMMPS_NS {

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@ -11,11 +11,11 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "create_atoms.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "delete_atoms.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -11,11 +11,11 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "stdlib.h"
#include "string.h"
#include "displace_atoms.h"
#include "lmptype.h"
#include "atom.h"
#include "modify.h"
#include "domain.h"

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@ -11,12 +11,12 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "displace_box.h"
#include "lmptype.h"
#include "atom.h"
#include "modify.h"
#include "domain.h"

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@ -11,12 +11,12 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "stdlib.h"
#include "string.h"
#include "stdio.h"
#include "dump.h"
#include "lmptype.h"
#include "atom.h"
#include "irregular.h"
#include "update.h"

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@ -14,9 +14,9 @@
#ifndef LMP_DUMP_H
#define LMP_DUMP_H
#include "lmptype.h"
#include "stdio.h"
#include "pointers.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -16,13 +16,13 @@
Axel Kohlmeyer (Temple U), support for groups
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "inttypes.h"
#include "stdio.h"
#include "time.h"
#include "string.h"
#include "dump_dcd.h"
#include "lmptype.h"
#include "domain.h"
#include "atom.h"
#include "update.h"

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@ -14,8 +14,8 @@
#ifndef LMP_FIX_H
#define LMP_FIX_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "fix_ave_atom.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "update.h"

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@ -20,9 +20,9 @@ FixStyle(ave/atom,FixAveAtom)
#ifndef LMP_FIX_AVE_ATOM_H
#define LMP_FIX_AVE_ATOM_H
#include "lmptype.h"
#include "stdio.h"
#include "fix.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -17,10 +17,10 @@
Reese Jones (Sandia)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "fix_ave_correlate.h"
#include "lmptype.h"
#include "update.h"
#include "modify.h"
#include "compute.h"

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@ -20,9 +20,9 @@ FixStyle(ave/correlate,FixAveCorrelate)
#ifndef LMP_FIX_AVE_CORRELATE_H
#define LMP_FIX_AVE_CORRELATE_H
#include "lmptype.h"
#include "stdio.h"
#include "fix.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "fix_ave_histo.h"
#include "lmptype.h"
#include "atom.h"
#include "update.h"
#include "modify.h"

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@ -20,9 +20,9 @@ FixStyle(ave/histo,FixAveHisto)
#ifndef LMP_FIX_AVE_HISTO_H
#define LMP_FIX_AVE_HISTO_H
#include "lmptype.h"
#include "stdio.h"
#include "fix.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -15,10 +15,10 @@
Contributing author: Pieter in 't Veld (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "fix_ave_spatial.h"
#include "lmptype.h"
#include "atom.h"
#include "update.h"
#include "force.h"

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@ -20,9 +20,9 @@ FixStyle(ave/spatial,FixAveSpatial)
#ifndef LMP_FIX_AVE_SPATIAL_H
#define LMP_FIX_AVE_SPATIAL_H
#include "lmptype.h"
#include "stdio.h"
#include "fix.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -15,10 +15,10 @@
Contributing author: Pieter in 't Veld (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "fix_ave_time.h"
#include "lmptype.h"
#include "update.h"
#include "modify.h"
#include "compute.h"

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@ -20,9 +20,9 @@ FixStyle(ave/time,FixAveTime)
#ifndef LMP_FIX_AVE_TIME_H
#define LMP_FIX_AVE_TIME_H
#include "lmptype.h"
#include "stdio.h"
#include "fix.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -20,8 +20,8 @@ FixStyle(dt/reset,FixDtReset)
#ifndef LMP_FIX_DT_RESET_H
#define LMP_FIX_DT_RESET_H
#include "fix.h"
#include "lmptype.h"
#include "fix.h"
namespace LAMMPS_NS {

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@ -11,13 +11,13 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "stdio.h"
#include "fix_shake.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "update.h"

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@ -20,8 +20,8 @@ FixStyle(shake,FixShake)
#ifndef LMP_FIX_SHAKE_H
#define LMP_FIX_SHAKE_H
#include "fix.h"
#include "lmptype.h"
#include "fix.h"
namespace LAMMPS_NS {

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@ -16,12 +16,12 @@
Christian Burisch (Bochum Univeristy, Germany)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "fix_tmd.h"
#include "lmptype.h"
#include "atom.h"
#include "update.h"
#include "modify.h"

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@ -16,12 +16,12 @@
Carolyn Phillips (University of Michigan)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "string.h"
#include "stdlib.h"
#include "fix_ttm.h"
#include "lmptype.h"
#include "atom.h"
#include "force.h"
#include "update.h"

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@ -11,13 +11,13 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "mpi.h"
#include "stdio.h"
#include "string.h"
#include "stdlib.h"
#include "group.h"
#include "lmptype.h"
#include "domain.h"
#include "atom.h"
#include "force.h"

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@ -14,9 +14,9 @@
#ifndef LMP_GROUP_H
#define LMP_GROUP_H
#include "lmptype.h"
#include "stdio.h"
#include "pointers.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -11,9 +11,9 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "integrate.h"
#include "lmptype.h"
#include "update.h"
#include "modify.h"
#include "compute.h"

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@ -14,8 +14,8 @@
#ifndef LMP_INTEGRATE_H
#define LMP_INTEGRATE_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -14,11 +14,11 @@
// C or Fortran style library interface to LAMMPS
// customize by adding new LAMMPS-specific functions
#include "lmptype.h"
#include "mpi.h"
#include "string.h"
#include "stdlib.h"
#include "library.h"
#include "lmptype.h"
#include "lammps.h"
#include "input.h"
#include "atom.h"

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@ -13,7 +13,7 @@
// define integer data types used by LAMMPS and associated size limits
// smallint = variables for system on 1 processor (nlocal, nmax, etc)
// smallint = variables for on-procesor system (nlocal, nmax, etc)
// tagint = variables for atom IDs (tag)
// bigint = variables for total system (natoms, ntimestep, etc)
@ -22,24 +22,21 @@
// NOTE: 64-bit tagint is not yet supported
// bigint can be 32-bit or 64-bit int, must be >= tagint
// MAXSMALLINT = max value of a smallint
// MAXTAGINT = max value of a tagint
// MAXBIGINT = max value of a bigint
// MPI_LMP_TAGINT = MPI data type corresponding to tagint
// MPI_LMP_BIGINT = MPI data type corresponding to bigint
// MPI_LMP_TAGINT = MPI data type corresponding to a tagint
// MPI_LMP_BIGINT = MPI data type corresponding to a bigint
// NOTE: if your machine/MPI does not support "long long" ints,
// but only "long" ints, then you will need to set
// MPI_LONG_LONG to MPI_LONG and atoll to atol
// but only "long" ints, then you will need to change
// MPI_LONG_LONG to MPI_LONG, and atoll to atol
#ifndef LMP_LMPTYPE_H
#define LMP_LMPTYPE_H
#include "limits.h"
#define __STDC_LIMIT_MACROS
#include "stdint.h"
#define __STDC_FORMAT_MACROS
#include "limits.h"
#include "stdint.h"
#include "inttypes.h"
namespace LAMMPS_NS {

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@ -11,12 +11,12 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "stdio.h"
#include "stdlib.h"
#include "string.h"
#include "memory.h"
#include "lmptype.h"
#include "error.h"
using namespace LAMMPS_NS;

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@ -19,11 +19,11 @@
JR Shewchuk, http://www-2.cs.cmu.edu/~jrs/jrspapers.html#cg
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "min.h"
#include "lmptype.h"
#include "atom.h"
#include "domain.h"
#include "comm.h"

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@ -14,8 +14,8 @@
#ifndef LMP_MIN_H
#define LMP_MIN_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -11,11 +11,11 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "string.h"
#include "min_cg.h"
#include "lmptype.h"
#include "atom.h"
#include "update.h"
#include "output.h"

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "min_quickmin.h"
#include "lmptype.h"
#include "universe.h"
#include "atom.h"
#include "force.h"

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@ -14,9 +14,9 @@
#ifndef LMP_MODIFY_H
#define LMP_MODIFY_H
#include "lmptype.h"
#include "stdio.h"
#include "pointers.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -11,8 +11,8 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "neighbor.h"
#include "lmptype.h"
#include "neighbor.h"
#include "atom.h"
#include "force.h"
#include "update.h"

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@ -15,12 +15,12 @@
Contributing author (triclinic and multi-neigh) : Pieter in 't Veld (SNL)
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdlib.h"
#include "string.h"
#include "neighbor.h"
#include "lmptype.h"
#include "neigh_list.h"
#include "neigh_request.h"
#include "atom.h"

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@ -14,8 +14,8 @@
#ifndef LMP_OUTPUT_H
#define LMP_OUTPUT_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -11,12 +11,12 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "math.h"
#include "mpi.h"
#include "string.h"
#include "stdlib.h"
#include "read_data.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "comm.h"

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@ -11,13 +11,13 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "string.h"
#include "stdlib.h"
#include "sys/types.h"
#include "dirent.h"
#include "read_restart.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "domain.h"

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@ -20,9 +20,9 @@ CommandStyle(read_restart,ReadRestart)
#ifndef LMP_READ_RESTART_H
#define LMP_READ_RESTART_H
#include "lmptype.h"
#include "stdio.h"
#include "pointers.h"
#include "lmptype.h"
namespace LAMMPS_NS {

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@ -14,8 +14,8 @@
#ifndef LMP_REGION_H
#define LMP_REGION_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "replicate.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "atom_vec_hybrid.h"

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "stdlib.h"
#include "string.h"
#include "run.h"
#include "lmptype.h"
#include "domain.h"
#include "update.h"
#include "integrate.h"

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@ -14,8 +14,8 @@
#ifndef LMP_THERMO_H
#define LMP_THERMO_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -14,8 +14,8 @@
#ifndef LMP_UPDATE_H
#define LMP_UPDATE_H
#include "pointers.h"
#include "lmptype.h"
#include "pointers.h"
namespace LAMMPS_NS {

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@ -11,13 +11,13 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "math.h"
#include "stdio.h"
#include "stdlib.h"
#include "string.h"
#include "velocity.h"
#include "lmptype.h"
#include "atom.h"
#include "update.h"
#include "domain.h"

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@ -11,10 +11,10 @@
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#include "lmptype.h"
#include "mpi.h"
#include "string.h"
#include "write_restart.h"
#include "lmptype.h"
#include "atom.h"
#include "atom_vec.h"
#include "atom_vec_hybrid.h"

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