Merge branch full-far-nbrs-list-charge-matrix.
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- PuReMD/src/allocate.c 342 additions, 163 deletionsPuReMD/src/allocate.c
- PuReMD/src/allocate.h 8 additions, 2 deletionsPuReMD/src/allocate.h
- PuReMD/src/basic_comm.c 523 additions, 92 deletionsPuReMD/src/basic_comm.c
- PuReMD/src/basic_comm.h 24 additions, 9 deletionsPuReMD/src/basic_comm.h
- PuReMD/src/bond_orders.c 230 additions, 78 deletionsPuReMD/src/bond_orders.c
- PuReMD/src/bond_orders.h 21 additions, 6 deletionsPuReMD/src/bond_orders.h
- PuReMD/src/box.c 4 additions, 0 deletionsPuReMD/src/box.c
- PuReMD/src/comm_tools.c 195 additions, 6 deletionsPuReMD/src/comm_tools.c
- PuReMD/src/comm_tools.h 6 additions, 0 deletionsPuReMD/src/comm_tools.h
- PuReMD/src/ffield.c 1 addition, 5 deletionsPuReMD/src/ffield.c
- PuReMD/src/forces.c 1931 additions, 486 deletionsPuReMD/src/forces.c
- PuReMD/src/forces.h 1 addition, 1 deletionPuReMD/src/forces.h
- PuReMD/src/geo_tools.c 16 additions, 22 deletionsPuReMD/src/geo_tools.c
- PuReMD/src/geo_tools.h 5 additions, 3 deletionsPuReMD/src/geo_tools.h
- PuReMD/src/grid.c 89 additions, 39 deletionsPuReMD/src/grid.c
- PuReMD/src/hydrogen_bonds.c 13 additions, 11 deletionsPuReMD/src/hydrogen_bonds.c
- PuReMD/src/init_md.c 240 additions, 164 deletionsPuReMD/src/init_md.c
- PuReMD/src/integrate.c 64 additions, 0 deletionsPuReMD/src/integrate.c
- PuReMD/src/io_tools.c 624 additions, 740 deletionsPuReMD/src/io_tools.c
- PuReMD/src/linear_solvers.c 2847 additions, 754 deletionsPuReMD/src/linear_solvers.c
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