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

src/ASPHERE/atom_vec_ellipsoid.cpp

@@ -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"

src/CLASS2/dihedral_class2.cpp

@@ -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"

src/CLASS2/improper_class2.cpp

@@ -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"

src/COLLOID/atom_vec_colloid.cpp

@@ -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"

src/DIPOLE/atom_vec_dipole.cpp

@@ -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"

src/GPU/pair_cg_cmm_coul_long_gpu.cpp

@@ -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"

src/GPU/pair_cg_cmm_gpu.cpp

@@ -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"

src/GPU/pair_gayberne_gpu.cpp

@@ -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"

src/GPU/pair_lj96_cut_gpu.cpp

@@ -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"

src/GPU/pair_lj_charmm_coul_long_gpu.cpp

@@ -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"

src/GPU/pair_lj_cut_coul_cut_gpu.cpp

@@ -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"

src/GPU/pair_lj_cut_coul_long_gpu.cpp

@@ -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"

src/GPU/pair_lj_cut_gpu.cpp

@@ -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"

src/GRANULAR/atom_vec_granular.cpp

@@ -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"

src/KSPACE/pppm.cpp

@@ -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"

src/KSPACE/pppm.h

@@ -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 {
 

src/MANYBODY/fix_qeq_comb.cpp

@@ -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"

src/MANYBODY/fix_qeq_comb.h

@@ -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 {
 

src/MOLECULE/atom_vec_angle.cpp

@@ -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"

src/MOLECULE/atom_vec_bond.cpp

@@ -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"

src/MOLECULE/atom_vec_full.cpp

@@ -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"

src/MOLECULE/atom_vec_molecular.cpp

@@ -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"

src/MOLECULE/bond_fene.cpp

@@ -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"

src/MOLECULE/bond_fene_expand.cpp

@@ -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"

src/MOLECULE/dihedral_charmm.cpp

@@ -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"

src/MOLECULE/dihedral_harmonic.cpp

@@ -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"

src/MOLECULE/dihedral_helix.cpp

@@ -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"

src/MOLECULE/dihedral_multi_harmonic.cpp

@@ -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"

src/MOLECULE/dihedral_opls.cpp

@@ -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"

src/MOLECULE/improper_cvff.cpp

@@ -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"

src/MOLECULE/improper_harmonic.cpp

@@ -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"

src/PERI/atom_vec_peri.cpp

@@ -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"

src/REAX/fix_reax_bonds.cpp

@@ -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"

src/REAX/fix_reax_bonds.h

@@ -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 {
 

src/REPLICA/fix_event_prd.cpp

@@ -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"

src/REPLICA/fix_event_prd.h

@@ -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 {
 

src/REPLICA/fix_event_tad.cpp

@@ -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"

src/REPLICA/fix_event_tad.h

@@ -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 {
 

src/REPLICA/neb.cpp

@@ -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"

src/REPLICA/prd.cpp

@@ -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"

src/REPLICA/temper.cpp

@@ -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"

src/SRD/fix_wall_srd.h

@@ -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 {
 

src/USER-EFF/atom_vec_electron.cpp

@@ -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"

src/atom.h

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

src/atom_vec_atomic.cpp

@@ -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"

src/atom_vec_charge.cpp

@@ -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"

src/atom_vec_hybrid.cpp

@@ -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"

src/compute.cpp

@@ -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"

src/compute.h

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

src/compute_reduce.cpp

@@ -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"

src/compute_reduce.h

@@ -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 {
 

src/compute_reduce_region.h

@@ -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 {
 

src/create_atoms.cpp

@@ -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"

src/delete_atoms.cpp

@@ -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"

src/displace_atoms.cpp

@@ -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"

src/displace_box.cpp

@@ -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"

src/dump.cpp

@@ -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"

src/dump.h

@@ -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 {
 

src/dump_dcd.cpp

@@ -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"

src/fix.h

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

src/fix_ave_atom.cpp

@@ -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"

src/fix_ave_atom.h

@@ -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 {
 

src/fix_ave_correlate.cpp

@@ -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"

src/fix_ave_correlate.h

@@ -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 {
 

src/fix_ave_histo.cpp

@@ -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"

src/fix_ave_histo.h

@@ -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 {
 

src/fix_ave_spatial.cpp

@@ -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"

src/fix_ave_spatial.h

@@ -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 {
 

src/fix_ave_time.cpp

@@ -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"

src/fix_ave_time.h

@@ -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 {
 

src/fix_dt_reset.h

@@ -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 {
 

src/fix_shake.cpp

@@ -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"

src/fix_shake.h

@@ -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 {
 

src/fix_tmd.cpp

@@ -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"

src/fix_ttm.cpp

@@ -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"

src/group.cpp

@@ -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"

src/group.h

@@ -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 {
 

src/integrate.cpp

@@ -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"

src/integrate.h

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

src/library.cpp

@@ -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"

src/lmptype.h

@@ -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 {

src/memory.cpp

@@ -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;

src/min.cpp

@@ -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"

src/min.h

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

src/min_cg.cpp

@@ -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"

src/min_quickmin.cpp

@@ -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"

src/modify.h

@@ -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 {
 

src/neigh_bond.cpp

@@ -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"

src/neighbor.cpp

@@ -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"

src/output.h

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

src/read_data.cpp

@@ -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"

src/read_restart.cpp

@@ -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"

src/read_restart.h

@@ -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 {
 

src/region.h

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

src/replicate.cpp

@@ -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"

src/run.cpp

@@ -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"

src/thermo.h

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

src/update.h

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

src/velocity.cpp

@@ -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"

src/write_restart.cpp

@@ -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"