fix_write_reax_bonds.txt
7b788ebd0e28lammm-master

fix_write_reax_bonds.txt
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			"LAMMPS WWW Site"_lws - "LAMMPS Documentation"_ld - "LAMMPS Commands"_lc :c

			:link(lws,http://lammps.sandia.gov)
			:link(ld,Manual.html)
			:link(lc,Section_commands.html#comm)

			:line

			fix write/reax/bonds command :h3

			[Syntax:]

			fix ID group-ID write/reax/bonds Nevery filename :pre

			ID, group-ID are documented in "fix"_fix.html command :ulb,l
			write/reax/bonds = style name of this fix command :l
			Nevery = output interval in timesteps :l
			filename = naem of output file

			[Examples:]

			fix 1 all write/reax/bonds 100 bonds.tatb

			[Description:]

			Write out the bond information computed by the
			ReaxFF potential ("pair_style reax"_pair_reax.html).
			During dynamics runs, the bond information is written
			to {filename} on timesteps that are multiples of
			{Nevery}, including timestep 0. No output is generated
			during minimization runs.

			:line

			[Restart, fix_modify, output, run start/stop, minimize info:]

			No information about this fix is written to "binary restart
			files"_restart.html. None of the "fix_modify"_fix_modify.html options
			are relevant to this fix. This fix does not provide any compute
			quantities.

			[Restrictions:]

			This fix requires that the "pair_style reax"_pair_reax.html be invoked.
			This fix is part of the "reax" package. It is only enabled if
			LAMMPS was built with that package, which also requires the REAX
			library be built and linked with LAMMPS. See the "Making
			LAMMPS"_Section_start.html#2_3 section for more info.

			[Related commands:]

			"pair_style reax"_pair_reax.html

			[Default:]

			none