forked from lijiext/lammps
67 lines
2.3 KiB
HTML
67 lines
2.3 KiB
HTML
<HTML>
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<CENTER><A HREF = "http://lammps.sandia.gov">LAMMPS WWW Site</A> - <A HREF = "Manual.html">LAMMPS Documentation</A> - <A HREF = "Section_commands.html#comm">LAMMPS Commands</A>
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</CENTER>
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<HR>
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<H3>reset_timestep command
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</H3>
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<P><B>Syntax:</B>
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</P>
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<PRE>reset_timestep N
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</PRE>
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<UL><LI>N = timestep number
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</UL>
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<P><B>Examples:</B>
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</P>
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<PRE>reset_timestep 0
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reset_timestep 4000000
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</PRE>
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<P><B>Description:</B>
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</P>
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<P>Set the timestep counter to the specified value. This command
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normally comes after the timestep has been set by reading a restart
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file via the <A HREF = "read_restart.html">read_restart</A> command, or a previous
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simulation advanced the timestep.
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</P>
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<P>The <A HREF = "read_data.html">read_data</A> and <A HREF = "create_box.html">create_box</A>
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commands set the timestep to 0; the <A HREF = "read_restart.html">read_restart</A>
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command sets the timestep to the value it had when the restart file
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was written.
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</P>
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<P><B>Restrictions:</B> none
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</P>
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<P>This command cannot be used when any fixes are defined that keep track
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of elapsed time to perform certain kinds of time-dependent operations.
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Examples are the <A HREF = "fix_deposit.html">fix deposit</A> and <A HREF = "fix_dt_reset.html">fix
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dt/reset</A> commands. The former adds atoms on
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specific timesteps. The latter keeps track of accumulated time.
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</P>
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<P>Various fixes use the current timestep to calculate related
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quantities. If the timestep is reset, this may produce unexpected
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behavior, but LAMMPS allows the fixes to be defined even if the
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timestep is reset. For example, commands which thermostat the system,
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e.g. <A HREF = "fix_nh.html">fix nvt</A>, allow you to specify a target temperature
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which ramps from Tstart to Tstop which may persist over several runs.
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If you change the timestep, you may induce an instantaneous change in
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the target temperature.
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</P>
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<P>Resetting the timestep clears flags for <A HREF = "compute.html">computes</A> that
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may have calculated some quantity from a previous run. This means
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these quantity cannot be accessed by a variable in between runs until
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a new run is performed. See the <A HREF = "variable.html">variable</A> command for
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more details.
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</P>
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<P><B>Related commands:</B>
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</P>
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<P><A HREF = "rerun.html">rerun</A>
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</P>
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<P><B>Default:</B> none
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</P>
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</HTML>
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