| Name | Last modified | Size | Description | |
|---|---|---|---|---|
| Parent Directory | - | |||
| README | 2024-05-21 01:10 | 2.8K | ||
| compute_spec_atom.cpp | 2024-05-21 01:10 | 16K | ||
| compute_spec_atom.h | 2024-05-21 01:10 | 2.3K | ||
| fix_qeq_reax.cpp | 2024-05-21 01:10 | 27K | ||
| fix_qeq_reax.h | 2024-05-21 01:10 | 4.1K | ||
| fix_reaxc.cpp | 2024-05-21 01:10 | 4.6K | ||
| fix_reaxc.h | 2024-05-21 01:10 | 1.9K | ||
| fix_reaxc_bonds.cpp | 2024-05-21 01:10 | 9.3K | ||
| fix_reaxc_bonds.h | 2024-05-21 01:10 | 1.5K | ||
| fix_reaxc_species.cpp | 2024-05-21 01:10 | 26K | ||
| fix_reaxc_species.h | 2024-05-21 01:10 | 2.2K | ||
| pair_reaxc.cpp | 2024-05-21 01:10 | 23K | ||
| pair_reaxc.h | 2024-05-21 01:10 | 2.7K | ||
| reaxc_allocate.cpp | 2024-05-21 01:10 | 18K | ||
| reaxc_allocate.h | 2024-05-21 01:10 | 1.6K | ||
| reaxc_bond_orders.cpp | 2024-05-21 01:10 | 22K | ||
| reaxc_bond_orders.h | 2024-05-21 01:10 | 1.8K | ||
| reaxc_bonds.cpp | 2024-05-21 01:10 | 5.0K | ||
| reaxc_bonds.h | 2024-05-21 01:10 | 1.3K | ||
| reaxc_control.cpp | 2024-05-21 01:10 | 12K | ||
| reaxc_control.h | 2024-05-21 01:10 | 1.2K | ||
| reaxc_defs.h | 2024-05-21 01:10 | 5.1K | ||
| reaxc_ffield.cpp | 2024-05-21 01:10 | 22K | ||
| reaxc_ffield.h | 2024-05-21 01:10 | 1.2K | ||
| reaxc_forces.cpp | 2024-05-21 01:10 | 14K | ||
| reaxc_forces.h | 2024-05-21 01:10 | 1.6K | ||
| reaxc_hydrogen_bonds.cpp | 2024-05-21 01:10 | 7.1K | ||
| reaxc_hydrogen_bonds.h | 2024-05-21 01:10 | 1.3K | ||
| reaxc_init_md.cpp | 2024-05-21 01:10 | 9.0K | ||
| reaxc_init_md.h | 2024-05-21 01:10 | 1.3K | ||
| reaxc_io_tools.cpp | 2024-05-21 01:10 | 5.0K | ||
| reaxc_io_tools.h | 2024-05-21 01:10 | 1.5K | ||
| reaxc_list.cpp | 2024-05-21 01:10 | 4.5K | ||
| reaxc_list.h | 2024-05-21 01:10 | 1.9K | ||
| reaxc_lookup.cpp | 2024-05-21 01:10 | 9.8K | ||
| reaxc_lookup.h | 2024-05-21 01:10 | 1.8K | ||
| reaxc_multi_body.cpp | 2024-05-21 01:10 | 8.5K | ||
| reaxc_multi_body.h | 2024-05-21 01:10 | 1.3K | ||
| reaxc_nonbonded.cpp | 2024-05-21 01:10 | 14K | ||
| reaxc_nonbonded.h | 2024-05-21 01:10 | 1.7K | ||
| reaxc_reset_tools.cpp | 2024-05-21 01:10 | 5.2K | ||
| reaxc_reset_tools.h | 2024-05-21 01:10 | 1.6K | ||
| reaxc_system_props.cpp | 2024-05-21 01:10 | 3.2K | ||
| reaxc_system_props.h | 2024-05-21 01:10 | 1.3K | ||
| reaxc_tool_box.cpp | 2024-05-21 01:10 | 3.0K | ||
| reaxc_tool_box.h | 2024-05-21 01:10 | 1.5K | ||
| reaxc_torsion_angles.cpp | 2024-05-21 01:10 | 20K | ||
| reaxc_torsion_angles.h | 2024-05-21 01:10 | 1.3K | ||
| reaxc_traj.cpp | 2024-05-21 01:10 | 29K | ||
| reaxc_traj.h | 2024-05-21 01:10 | 3.2K | ||
| reaxc_types.h | 2024-05-21 01:10 | 18K | ||
| reaxc_valence_angles.cpp | 2024-05-21 01:10 | 16K | ||
| reaxc_valence_angles.h | 2024-05-21 01:10 | 1.5K | ||
| reaxc_vector.cpp | 2024-05-21 01:10 | 3.3K | ||
| reaxc_vector.h | 2024-05-21 01:10 | 1.8K | ||