7c3f619e13
- moved examples/SPIN/gneb/interpolate/ toward tools/spin/interpolate/gneb - added gneb in the command files in doc/src - modified the error messages in neb_spin.h/cpp
142 lines
3.3 KiB
Plaintext
142 lines
3.3 KiB
Plaintext
"Higher level section"_Commands.html - "LAMMPS WWW Site"_lws - "LAMMPS
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Documentation"_ld - "LAMMPS Commands"_lc :c
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:link(lws,http://lammps.sandia.gov)
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:link(ld,Manual.html)
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:link(lc,Commands_all.html)
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:line
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Commands by category :h3
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This page lists most of the LAMMPS commands, grouped by category. The
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"General commands"_Commands_all.html doc page lists all general commands
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alphabetically. Style options for entries like fix, compute, pair etc.
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have their own pages where they are listed alphabetically.
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Initialization:
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"newton"_newton.html,
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"package"_package.html,
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"processors"_processors.html,
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"suffix"_suffix.html,
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"units"_units.html :ul
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Setup simulation box:
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"boundary"_boundary.html,
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"box"_box.html,
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"change_box"_change_box.html,
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"create_box"_create_box.html,
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"dimension"_dimension.html,
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"lattice"_lattice.html,
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"region"_region.html :ul
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Setup atoms:
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"atom_modify"_atom_modify.html,
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"atom_style"_atom_style.html,
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"balance"_balance.html,
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"create_atoms"_create_atoms.html,
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"create_bonds"_create_bonds.html,
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"delete_atoms"_delete_atoms.html,
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"delete_bonds"_delete_bonds.html,
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"displace_atoms"_displace_atoms.html,
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"group"_group.html,
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"mass"_mass.html,
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"molecule"_molecule.html,
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"read_data"_read_data.html,
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"read_dump"_read_dump.html,
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"read_restart"_read_restart.html,
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"replicate"_replicate.html,
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"set"_set.html,
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"velocity"_velocity.html :ul
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Force fields:
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"angle_coeff"_angle_coeff.html,
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"angle_style"_angle_style.html,
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"bond_coeff"_bond_coeff.html,
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"bond_style"_bond_style.html,
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"bond_write"_bond_write.html,
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"dielectric"_dielectric.html,
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"dihedral_coeff"_dihedral_coeff.html,
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"dihedral_style"_dihedral_style.html,
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"improper_coeff"_improper_coeff.html,
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"improper_style"_improper_style.html,
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"kspace_modify"_kspace_modify.html,
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"kspace_style"_kspace_style.html,
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"pair_coeff"_pair_coeff.html,
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"pair_modify"_pair_modify.html,
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"pair_style"_pair_style.html,
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"pair_write"_pair_write.html,
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"special_bonds"_special_bonds.html :ul
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Settings:
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"comm_modify"_comm_modify.html,
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"comm_style"_comm_style.html,
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"info"_info.html,
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"min_modify"_min_modify.html,
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"min_style"_min_style.html,
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"neigh_modify"_neigh_modify.html,
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"neighbor"_neighbor.html,
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"partition"_partition.html,
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"reset_timestep"_reset_timestep.html,
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"run_style"_run_style.html,
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"timer"_timer.html,
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"timestep"_timestep.html :ul
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Operations within timestepping (fixes) and diagnostics (computes):
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"compute"_compute.html,
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"compute_modify"_compute_modify.html,
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"fix"_fix.html,
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"fix_modify"_fix_modify.html,
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"uncompute"_uncompute.html,
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"unfix"_unfix.html :ul
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Output:
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"dump image"_dump_image.html,
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"dump movie"_dump_image.html,
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"dump"_dump.html,
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"dump_modify"_dump_modify.html,
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"restart"_restart.html,
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"thermo"_thermo.html,
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"thermo_modify"_thermo_modify.html,
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"thermo_style"_thermo_style.html,
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"undump"_undump.html,
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"write_coeff"_write_coeff.html,
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"write_data"_write_data.html,
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"write_dump"_write_dump.html,
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"write_restart"_write_restart.html :ul
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Actions:
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"minimize"_minimize.html,
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"neb"_neb.html,
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"neb_spin"_neb_spin.html,
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"prd"_prd.html,
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"rerun"_rerun.html,
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"run"_run.html,
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"tad"_tad.html,
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"temper"_temper.html :ul
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Input script control:
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"clear"_clear.html,
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"echo"_echo.html,
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"if"_if.html,
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"include"_include.html,
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"jump"_jump.html,
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"label"_label.html,
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"log"_log.html,
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"next"_next.html,
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"print"_print.html,
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"python"_python.html,
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"quit"_quit.html,
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"shell"_shell.html,
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"variable"_variable.html :ul
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