forked from lijiext/lammps
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6838 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
parent
fe1132af69
commit
6ce9c2bb67
|
@ -354,8 +354,9 @@ of each style or click on the style itself for a full description:
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|||
package</A>.
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</P>
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||||
<DIV ALIGN=center><TABLE BORDER=1 >
|
||||
<TR ALIGN="center"><TD ><A HREF = "fix_atc.html">atc</A></TD><TD ><A HREF = "fix_imd.html">imd</A></TD><TD ><A HREF = "fix_langevin_eff.html">langevin/eff</A></TD><TD ><A HREF = "fix_nh_eff.html">nph/eff</A></TD><TD ><A HREF = "fix_nh_eff.html">npt/eff</A></TD><TD ><A HREF = "fix_nve_eff.html">nve/eff</A></TD></TR>
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||||
<TR ALIGN="center"><TD ><A HREF = "fix_nh_eff.html">nvt/eff</A></TD><TD ><A HREF = "fix_nvt_sllod_eff.html">nvt/sllod/eff</A></TD><TD ><A HREF = "fix_qeq_reax.html">qeq/reax</A></TD><TD ><A HREF = "fix_smd.html">smd</A></TD><TD ><A HREF = "fix_temp_rescale_eff.html">temp/rescale/eff</A>
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<TR ALIGN="center"><TD ><A HREF = "fix_atc.html">atc</A></TD><TD ><A HREF = "fix_imd.html">imd</A></TD><TD ><A HREF = "fix_langevin_eff.html">langevin/eff</A></TD><TD ><A HREF = "fix_meso.html">meso</A></TD><TD ><A HREF = "fix_meso_stationary.html">meso/stationary</A></TD><TD ><A HREF = "fix_nh_eff.html">nph/eff</A></TD></TR>
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<TR ALIGN="center"><TD ><A HREF = "fix_nh_eff.html">npt/eff</A></TD><TD ><A HREF = "fix_nve_eff.html">nve/eff</A></TD><TD ><A HREF = "fix_nh_eff.html">nvt/eff</A></TD><TD ><A HREF = "fix_nvt_sllod_eff.html">nvt/sllod/eff</A></TD><TD ><A HREF = "fix_qeq_reax.html">qeq/reax</A></TD><TD ><A HREF = "fix_smd.html">smd</A></TD></TR>
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<TR ALIGN="center"><TD ><A HREF = "fix_temp_rescale_eff.html">temp/rescale/eff</A>
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</TD></TR></TABLE></DIV>
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<P>These are accelerated fix styles, which can be used if LAMMPS is
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|
@ -391,8 +392,8 @@ each style or click on the style itself for a full description:
|
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package</A>.
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</P>
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<DIV ALIGN=center><TABLE BORDER=1 >
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<TR ALIGN="center"><TD ><A HREF = "compute_ackland_atom.html">ackland/atom</A></TD><TD ><A HREF = "compute_ke_eff.html">ke/eff</A></TD><TD ><A HREF = "compute_ke_atom_eff.html">ke/atom/eff</A></TD><TD ><A HREF = "compute_temp_eff.html">temp/eff</A></TD><TD ><A HREF = "compute_temp_deform_eff.html">temp/deform/eff</A></TD><TD ><A HREF = "compute_temp_region_eff.html">temp/region/eff</A></TD></TR>
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<TR ALIGN="center"><TD ><A HREF = "compute_temp_rotate.html">temp/rotate</A>
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<TR ALIGN="center"><TD ><A HREF = "compute_ackland_atom.html">ackland/atom</A></TD><TD ><A HREF = "compute_ke_eff.html">ke/eff</A></TD><TD ><A HREF = "compute_ke_atom_eff.html">ke/atom/eff</A></TD><TD ><A HREF = "compute_meso_e_atom.html">meso_e/atom</A></TD><TD ><A HREF = "compute_meso_rho_atom.html">meso_rho/atom</A></TD><TD ><A HREF = "compute_meso_t_atom.html">meso_t/atom</A></TD></TR>
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<TR ALIGN="center"><TD ><A HREF = "compute_temp_eff.html">temp/eff</A></TD><TD ><A HREF = "compute_temp_deform_eff.html">temp/deform/eff</A></TD><TD ><A HREF = "compute_temp_region_eff.html">temp/region/eff</A></TD><TD ><A HREF = "compute_temp_rotate.html">temp/rotate</A>
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</TD></TR></TABLE></DIV>
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<P>These are accelerated compute styles, which can be used if LAMMPS is
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@ -436,7 +437,8 @@ package</A>.
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<DIV ALIGN=center><TABLE BORDER=1 >
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<TR ALIGN="center"><TD ><A HREF = "pair_awpmd.html">awpmd/cut</A></TD><TD ><A HREF = "pair_buck_coul.html">buck/coul</A></TD><TD ><A HREF = "pair_cmm.html">cg/cmm</A></TD><TD ><A HREF = "pair_cmm.html">cg/cmm/coul/cut</A></TD></TR>
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<TR ALIGN="center"><TD ><A HREF = "pair_cmm.html">cg/cmm/coul/long</A></TD><TD ><A HREF = "pair_dipole.html">dipole/sf</A></TD><TD ><A HREF = "pair_eam.html">eam/cd</A></TD><TD ><A HREF = "pair_eff.html">eff/cut</A></TD></TR>
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<TR ALIGN="center"><TD ><A HREF = "pair_lj_coul.html">lj/coul</A></TD><TD ><A HREF = "pair_lj_sf.html">lj/sf</A></TD><TD ><A HREF = "pair_reax_c.html">reax/c</A>
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<TR ALIGN="center"><TD ><A HREF = "pair_lj_coul.html">lj/coul</A></TD><TD ><A HREF = "pair_lj_sf.html">lj/sf</A></TD><TD ><A HREF = "pair_reax_c.html">reax/c</A><A HREF = "pair_heatconduction.html">sph/heatconduction</A></TD><TD ><A HREF = "pair_idealgas.html">sph/idealgas</A></TD></TR>
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<TR ALIGN="center"><TD ><A HREF = "pair_lj.html">sph/lj</A></TD><TD ><A HREF = "pair_rhosum.html">sph/rhosum</A></TD><TD ><A HREF = "pair_taitwater.html">sph/taitwater</A></TD><TD ><A HREF = "pair_taitwater_morris.html">sph/taitwater/morris</A>
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</TD></TR></TABLE></DIV>
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<P>These are accelerated pair styles, which can be used if LAMMPS is
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|
|
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@ -487,6 +487,8 @@ package"_Section_start.html#start_3.
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"atc"_fix_atc.html,
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"imd"_fix_imd.html,
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"langevin/eff"_fix_langevin_eff.html,
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"meso"_fix_meso.html,
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"meso/stationary"_fix_meso_stationary.html,
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"nph/eff"_fix_nh_eff.html,
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"npt/eff"_fix_nh_eff.html,
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"nve/eff"_fix_nve_eff.html,
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|
@ -578,6 +580,9 @@ package"_Section_start.html#start_3.
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"ackland/atom"_compute_ackland_atom.html,
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"ke/eff"_compute_ke_eff.html,
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"ke/atom/eff"_compute_ke_atom_eff.html,
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"meso_e/atom"_compute_meso_e_atom.html,
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"meso_rho/atom"_compute_meso_rho_atom.html,
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"meso_t/atom"_compute_meso_t_atom.html,
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"temp/eff"_compute_temp_eff.html,
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"temp/deform/eff"_compute_temp_deform_eff.html,
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"temp/region/eff"_compute_temp_region_eff.html,
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|
@ -675,7 +680,13 @@ package"_Section_start.html#start_3.
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"eff/cut"_pair_eff.html,
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"lj/coul"_pair_lj_coul.html,
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"lj/sf"_pair_lj_sf.html,
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"reax/c"_pair_reax_c.html :tb(c=4,ea=c)
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"reax/c"_pair_reax_c.html
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"sph/heatconduction"_pair_heatconduction.html,
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"sph/idealgas"_pair_idealgas.html,
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"sph/lj"_pair_lj.html,
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"sph/rhosum"_pair_rhosum.html,
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"sph/taitwater"_pair_taitwater.html,
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"sph/taitwater/morris"_pair_taitwater_morris.html :tb(c=4,ea=c)
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These are accelerated pair styles, which can be used if LAMMPS is
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built with the "appropriate accelerated
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|
|
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@ -0,0 +1,54 @@
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<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>compute meso_e/atom command
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</H3>
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<P><B>Syntax:</B>
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</P>
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<PRE>compute ID group-ID meso_e/atom
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</PRE>
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<UL><LI>ID, group-ID are documented in <A HREF = "compute.html">compute</A> command
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<LI>meso_e/atom = style name of this compute command
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</UL>
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<P><B>Examples:</B>
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</P>
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<PRE>compute 1 all meso_e/atom
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</PRE>
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<P><B>Description:</B>
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</P>
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<P>Define a computation that calculates the per-atom internal energy
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for each atom in a group.
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</P>
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<P>The internal energy is the energy associated with the internal degrees
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of freedom of a mesoscopic particles, e.g. a Smooth-Particle
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Hydrodynamics particle.
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</P>
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<P>The value of the internal energy will be 0.0 for atoms not in the
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specified compute group.
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</P>
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<P><B>Output info:</B>
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</P>
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<P>This compute calculates a per-atom vector, which can be accessed by
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any command that uses per-atom values from a compute as input. See
|
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<A HREF = "Section_howto.html#4_15">this section</A> for an overview of LAMMPS
|
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output options.
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</P>
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<P>The per-atom vector values will be in energy <A HREF = "units.html">units</A>.
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</P>
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<P><B>Restrictions:</B> none
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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 = "dump.html">dump custom</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>
|
|
@ -0,0 +1,49 @@
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|||
"LAMMPS WWW Site"_lws - "LAMMPS Documentation"_ld - "LAMMPS Commands"_lc :c
|
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|
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:link(lws,http://lammps.sandia.gov)
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:link(ld,Manual.html)
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:link(lc,Section_commands.html#comm)
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:line
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compute meso_e/atom command :h3
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[Syntax:]
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compute ID group-ID meso_e/atom :pre
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ID, group-ID are documented in "compute"_compute.html command
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meso_e/atom = style name of this compute command :ul
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|
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[Examples:]
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|
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compute 1 all meso_e/atom :pre
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|
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[Description:]
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|
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Define a computation that calculates the per-atom internal energy
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for each atom in a group.
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|
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The internal energy is the energy associated with the internal degrees
|
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of freedom of a mesoscopic particles, e.g. a Smooth-Particle
|
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Hydrodynamics particle.
|
||||
|
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The value of the internal energy will be 0.0 for atoms not in the
|
||||
specified compute group.
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||||
|
||||
[Output info:]
|
||||
|
||||
This compute calculates a per-atom vector, which can be accessed by
|
||||
any command that uses per-atom values from a compute as input. See
|
||||
"this section"_Section_howto.html#4_15 for an overview of LAMMPS
|
||||
output options.
|
||||
|
||||
The per-atom vector values will be in energy "units"_units.html.
|
||||
|
||||
[Restrictions:] none
|
||||
|
||||
[Related commands:]
|
||||
|
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"dump custom"_dump.html
|
||||
|
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[Default:] none
|
|
@ -0,0 +1,54 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>compute meso_rho/atom command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>compute ID group-ID meso_rho/atom
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||||
</PRE>
|
||||
<UL><LI>ID, group-ID are documented in <A HREF = "compute.html">compute</A> command
|
||||
<LI>meso_rho/atom = style name of this compute command
|
||||
</UL>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<PRE>compute 1 all meso_rho/atom
|
||||
</PRE>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>Define a computation that calculates the per-atom mesoscopic density
|
||||
for each atom in a group.
|
||||
</P>
|
||||
<P>The mesoscopic density is the mass density of a mesoscopic particle,
|
||||
calculated by kernel function interpolation using
|
||||
"pair style sph/rhosum".
|
||||
</P>
|
||||
<P>The value of the mesoscopic density will be 0.0 for atoms not in the
|
||||
specified compute group.
|
||||
</P>
|
||||
<P><B>Output info:</B>
|
||||
</P>
|
||||
<P>This compute calculates a per-atom vector, which can be accessed by
|
||||
any command that uses per-atom values from a compute as input. See
|
||||
<A HREF = "Section_howto.html#4_15">this section</A> for an overview of LAMMPS
|
||||
output options.
|
||||
</P>
|
||||
<P>The per-atom vector values will be in mass / volume <A HREF = "units.html">units</A>.
|
||||
</P>
|
||||
<P><B>Restrictions:</B> none
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "dump.html">dump custom</A>
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,49 @@
|
|||
"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
|
||||
|
||||
compute meso_rho/atom command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
compute ID group-ID meso_rho/atom :pre
|
||||
|
||||
ID, group-ID are documented in "compute"_compute.html command
|
||||
meso_rho/atom = style name of this compute command :ul
|
||||
|
||||
[Examples:]
|
||||
|
||||
compute 1 all meso_rho/atom :pre
|
||||
|
||||
[Description:]
|
||||
|
||||
Define a computation that calculates the per-atom mesoscopic density
|
||||
for each atom in a group.
|
||||
|
||||
The mesoscopic density is the mass density of a mesoscopic particle,
|
||||
calculated by kernel function interpolation using
|
||||
"pair style sph/rhosum".
|
||||
|
||||
The value of the mesoscopic density will be 0.0 for atoms not in the
|
||||
specified compute group.
|
||||
|
||||
[Output info:]
|
||||
|
||||
This compute calculates a per-atom vector, which can be accessed by
|
||||
any command that uses per-atom values from a compute as input. See
|
||||
"this section"_Section_howto.html#4_15 for an overview of LAMMPS
|
||||
output options.
|
||||
|
||||
The per-atom vector values will be in mass / volume "units"_units.html.
|
||||
|
||||
[Restrictions:] none
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"dump custom"_dump.html
|
||||
|
||||
[Default:] none
|
|
@ -0,0 +1,56 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>compute meso_t/atom command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>compute ID group-ID meso_t/atom
|
||||
</PRE>
|
||||
<UL><LI>ID, group-ID are documented in <A HREF = "compute.html">compute</A> command
|
||||
<LI>meso_t/atom = style name of this compute command
|
||||
</UL>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<PRE>compute 1 all meso_t/atom
|
||||
</PRE>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>Define a computation that calculates the per-atom internal temperature
|
||||
for each atom in a group.
|
||||
</P>
|
||||
<P>The internal temperature is the ratio of internal energy over the heat
|
||||
capacity associated with the internal degrees of freedom of a mesoscopic
|
||||
particles, e.g. a Smooth-Particle Hydrodynamics particle.
|
||||
</P>
|
||||
<P>T_<I>int</I> = E_<I>int</I> / C_<I>V, int</I>
|
||||
</P>
|
||||
<P>The value of the internal energy will be 0.0 for atoms not in the
|
||||
specified compute group.
|
||||
</P>
|
||||
<P><B>Output info:</B>
|
||||
</P>
|
||||
<P>This compute calculates a per-atom vector, which can be accessed by
|
||||
any command that uses per-atom values from a compute as input. See
|
||||
<A HREF = "Section_howto.html#4_15">this section</A> for an overview of LAMMPS
|
||||
output options.
|
||||
</P>
|
||||
<P>The per-atom vector values will be in temperature <A HREF = "units.html">units</A>.
|
||||
</P>
|
||||
<P><B>Restrictions:</B> none
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "dump.html">dump custom</A>
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,51 @@
|
|||
"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
|
||||
|
||||
compute meso_t/atom command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
compute ID group-ID meso_t/atom :pre
|
||||
|
||||
ID, group-ID are documented in "compute"_compute.html command
|
||||
meso_t/atom = style name of this compute command :ul
|
||||
|
||||
[Examples:]
|
||||
|
||||
compute 1 all meso_t/atom :pre
|
||||
|
||||
[Description:]
|
||||
|
||||
Define a computation that calculates the per-atom internal temperature
|
||||
for each atom in a group.
|
||||
|
||||
The internal temperature is the ratio of internal energy over the heat
|
||||
capacity associated with the internal degrees of freedom of a mesoscopic
|
||||
particles, e.g. a Smooth-Particle Hydrodynamics particle.
|
||||
|
||||
T_{int} = E_{int} / C_{V, int}
|
||||
|
||||
The value of the internal energy will be 0.0 for atoms not in the
|
||||
specified compute group.
|
||||
|
||||
[Output info:]
|
||||
|
||||
This compute calculates a per-atom vector, which can be accessed by
|
||||
any command that uses per-atom values from a compute as input. See
|
||||
"this section"_Section_howto.html#4_15 for an overview of LAMMPS
|
||||
output options.
|
||||
|
||||
The per-atom vector values will be in temperature "units"_units.html.
|
||||
|
||||
[Restrictions:] none
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"dump custom"_dump.html
|
||||
|
||||
[Default:] none
|
|
@ -0,0 +1,49 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>fix meso command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>fix ID group-ID meso
|
||||
</PRE>
|
||||
<UL><LI>ID, group-ID are documented in <A HREF = "fix.html">fix</A> command
|
||||
<LI>meso = style name of this fix command
|
||||
</UL>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<PRE>fix 1 all meso
|
||||
</PRE>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>Perform time integration to update position, velocity, internal energy
|
||||
and local density for atoms in the group each timestep. This fix is needed to
|
||||
time-integrate mesoscopic systems where particles carry internal variables such as SPH or DPDE.
|
||||
</P>
|
||||
<P><B>Restart, fix_modify, output, run start/stop, minimize info:</B>
|
||||
</P>
|
||||
<P>No information about this fix is written to <A HREF = "restart.html">binary restart
|
||||
files</A>. None of the <A HREF = "fix_modify.html">fix_modify</A> options
|
||||
are relevant to this fix. No global or per-atom quantities are stored
|
||||
by this fix for access by various <A HREF = "Section_howto.html#4_15">output
|
||||
commands</A>. No parameter of this fix can be
|
||||
used with the <I>start/stop</I> keywords of the <A HREF = "run.html">run</A> command.
|
||||
This fix is not invoked during <A HREF = "minimize.html">energy minimization</A>.
|
||||
</P>
|
||||
<P><B>Restrictions:</B> none
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P>"fix meso/stationary"
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,44 @@
|
|||
"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 meso command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
fix ID group-ID meso :pre
|
||||
|
||||
ID, group-ID are documented in "fix"_fix.html command
|
||||
meso = style name of this fix command :ul
|
||||
|
||||
[Examples:]
|
||||
|
||||
fix 1 all meso :pre
|
||||
|
||||
[Description:]
|
||||
|
||||
Perform time integration to update position, velocity, internal energy
|
||||
and local density for atoms in the group each timestep. This fix is needed to
|
||||
time-integrate mesoscopic systems where particles carry internal variables such as SPH or DPDE.
|
||||
|
||||
[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. No global or per-atom quantities are stored
|
||||
by this fix for access by various "output
|
||||
commands"_Section_howto.html#4_15. No parameter of this fix can be
|
||||
used with the {start/stop} keywords of the "run"_run.html command.
|
||||
This fix is not invoked during "energy minimization"_minimize.html.
|
||||
|
||||
[Restrictions:] none
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"fix meso/stationary"
|
||||
|
||||
[Default:] none
|
|
@ -0,0 +1,50 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>fix meso/stationary command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>fix ID group-ID meso/stationary
|
||||
</PRE>
|
||||
<UL><LI>ID, group-ID are documented in <A HREF = "fix.html">fix</A> command
|
||||
<LI>meso = style name of this fix command
|
||||
</UL>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<PRE>fix 1 boundary meso/stationary
|
||||
</PRE>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>Perform time integration to update internal energy and local density, but not
|
||||
position or velocity for atoms in the group each timestep. This fix is needed
|
||||
for SPH simulations to correctly time-integrate fixed boundary particles which
|
||||
constrain a fluid to a given region in space.
|
||||
</P>
|
||||
<P><B>Restart, fix_modify, output, run start/stop, minimize info:</B>
|
||||
</P>
|
||||
<P>No information about this fix is written to <A HREF = "restart.html">binary restart
|
||||
files</A>. None of the <A HREF = "fix_modify.html">fix_modify</A> options
|
||||
are relevant to this fix. No global or per-atom quantities are stored
|
||||
by this fix for access by various <A HREF = "Section_howto.html#4_15">output
|
||||
commands</A>. No parameter of this fix can be
|
||||
used with the <I>start/stop</I> keywords of the <A HREF = "run.html">run</A> command.
|
||||
This fix is not invoked during <A HREF = "minimize.html">energy minimization</A>.
|
||||
</P>
|
||||
<P><B>Restrictions:</B> none
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P>"fix meso"
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,45 @@
|
|||
"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 meso/stationary command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
fix ID group-ID meso/stationary :pre
|
||||
|
||||
ID, group-ID are documented in "fix"_fix.html command
|
||||
meso = style name of this fix command :ul
|
||||
|
||||
[Examples:]
|
||||
|
||||
fix 1 boundary meso/stationary :pre
|
||||
|
||||
[Description:]
|
||||
|
||||
Perform time integration to update internal energy and local density, but not
|
||||
position or velocity for atoms in the group each timestep. This fix is needed
|
||||
for SPH simulations to correctly time-integrate fixed boundary particles which
|
||||
constrain a fluid to a given region in space.
|
||||
|
||||
[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. No global or per-atom quantities are stored
|
||||
by this fix for access by various "output
|
||||
commands"_Section_howto.html#4_15. No parameter of this fix can be
|
||||
used with the {start/stop} keywords of the "run"_run.html command.
|
||||
This fix is not invoked during "energy minimization"_minimize.html.
|
||||
|
||||
[Restrictions:] none
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"fix meso"
|
||||
|
||||
[Default:] none
|
|
@ -0,0 +1,63 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>pair_style sph/heatconduction command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>pair_style sph/heatconduction
|
||||
</PRE>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<P>pair_style sph/heatconduction
|
||||
pair_coeff * * 1.0 2.4
|
||||
</P>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>The sph/heatconduction style computes heat transport between SPH particles.
|
||||
The transport model is the diffusion euqation for the internal energy.
|
||||
</P>
|
||||
<P>The following coefficients must be defined for each pair of atoms
|
||||
types via the <A HREF = "pair_coeff.html">pair_coeff</A> command as in the examples
|
||||
above.
|
||||
</P>
|
||||
<P>D diffusion coefficient (length^2/time units)
|
||||
h kernel function cutoff (distance units)
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<P><B>Mixing, shift, table, tail correction, restart, rRESPA info</B>:
|
||||
</P>
|
||||
<P>These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly.
|
||||
</P>
|
||||
<P>This style does not write information to <A HREF = "restart.html">binary restart
|
||||
files</A>, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
</P>
|
||||
<P>These styles can only be used via the <I>pair</I> keyword of the <A HREF = "run_style.html">run_style
|
||||
respa</A> command. They do not support the <I>inner</I>,
|
||||
<I>middle</I>, <I>outer</I> keywords.
|
||||
</P>
|
||||
<P><B>Restrictions:</B>
|
||||
</P>
|
||||
<P>The <I>pair sph/heatconduction</I> style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the <A HREF = "Section_start.html#2_3">Making LAMMPS</A> section for
|
||||
more info.
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "pair_coeff.html">pair_coeff</A>, pair_sph/rhosum
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,59 @@
|
|||
"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
|
||||
|
||||
pair_style sph/heatconduction command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
pair_style sph/heatconduction :pre
|
||||
|
||||
[Examples:]
|
||||
|
||||
pair_style sph/heatconduction
|
||||
pair_coeff * * 1.0 2.4
|
||||
|
||||
[Description:]
|
||||
|
||||
The sph/heatconduction style computes heat transport between SPH particles.
|
||||
The transport model is the diffusion euqation for the internal energy.
|
||||
|
||||
The following coefficients must be defined for each pair of atoms
|
||||
types via the "pair_coeff"_pair_coeff.html command as in the examples
|
||||
above.
|
||||
|
||||
D diffusion coefficient (length^2/time units)
|
||||
h kernel function cutoff (distance units)
|
||||
|
||||
:line
|
||||
|
||||
[Mixing, shift, table, tail correction, restart, rRESPA info]:
|
||||
|
||||
These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly.
|
||||
|
||||
This style does not write information to "binary restart
|
||||
files"_restart.html, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
|
||||
These styles can only be used via the {pair} keyword of the "run_style
|
||||
respa"_run_style.html command. They do not support the {inner},
|
||||
{middle}, {outer} keywords.
|
||||
|
||||
[Restrictions:]
|
||||
|
||||
The {pair sph/heatconduction} style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the "Making LAMMPS"_Section_start.html#2_3 section for
|
||||
more info.
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"pair_coeff"_pair_coeff.html, pair_sph/rhosum
|
||||
|
||||
[Default:] none
|
||||
|
|
@ -0,0 +1,68 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>pair_style sph/idealgas command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>pair_style sph/idealgas
|
||||
</PRE>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<P>pair_style sph/idealgas
|
||||
pair_coeff * * 1.0 2.4
|
||||
</P>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>The sph/idealgas style computes pressure forces between particles according to the ideal gas equation of state,
|
||||
\begin<I>equation</I>
|
||||
p = (\gamma - 1) \rho e,
|
||||
\end<I>equation</I>
|
||||
where $\gamma=1.4$ is the heat capacity ratio, $\rho$ is the local density, and $e$ is the internal energy per unit mass. This pair style also computes Monaghan's artificial viscosity to prevent particles from interpentrating (Monaghan1983).
|
||||
</P>
|
||||
<P>The following coefficients must be defined for each pair of atoms
|
||||
types via the <A HREF = "pair_coeff.html">pair_coeff</A> command as in the examples
|
||||
above.
|
||||
</P>
|
||||
<P>nu artificial viscosity (no units)
|
||||
h kernel function cutoff (distance units)
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<P><B>Mixing, shift, table, tail correction, restart, rRESPA info</B>:
|
||||
</P>
|
||||
<P>These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly.
|
||||
</P>
|
||||
<P>This style does not write information to <A HREF = "restart.html">binary restart
|
||||
files</A>, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
</P>
|
||||
<P>These styles can only be used via the <I>pair</I> keyword of the <A HREF = "run_style.html">run_style
|
||||
respa</A> command. They do not support the <I>inner</I>,
|
||||
<I>middle</I>, <I>outer</I> keywords.
|
||||
</P>
|
||||
<P><B>Restrictions:</B>
|
||||
</P>
|
||||
<P>The <I>pair sph/idealgas</I> style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the <A HREF = "Section_start.html#2_3">Making LAMMPS</A> section for
|
||||
more info.
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "pair_coeff.html">pair_coeff</A>, pair_sph/rhosum
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
<P><B>(Monaghan1983)</B> J. J. Monaghan and R. A. Gingold, “Shock simulation by the particle method SPH,” Journal of Computational Physics, vol. 52, no. 2, pp. 374-389, Nov. 1983.
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,65 @@
|
|||
"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
|
||||
|
||||
pair_style sph/idealgas command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
pair_style sph/idealgas :pre
|
||||
|
||||
[Examples:]
|
||||
|
||||
pair_style sph/idealgas
|
||||
pair_coeff * * 1.0 2.4
|
||||
|
||||
[Description:]
|
||||
|
||||
The sph/idealgas style computes pressure forces between particles according to the ideal gas equation of state,
|
||||
\begin{equation}
|
||||
p = (\gamma - 1) \rho e,
|
||||
\end{equation}
|
||||
where $\gamma=1.4$ is the heat capacity ratio, $\rho$ is the local density, and $e$ is the internal energy per unit mass. This pair style also computes Monaghan's artificial viscosity to prevent particles from interpentrating (Monaghan1983).
|
||||
|
||||
|
||||
The following coefficients must be defined for each pair of atoms
|
||||
types via the "pair_coeff"_pair_coeff.html command as in the examples
|
||||
above.
|
||||
|
||||
nu artificial viscosity (no units)
|
||||
h kernel function cutoff (distance units)
|
||||
|
||||
:line
|
||||
|
||||
[Mixing, shift, table, tail correction, restart, rRESPA info]:
|
||||
|
||||
These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly.
|
||||
|
||||
This style does not write information to "binary restart
|
||||
files"_restart.html, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
|
||||
These styles can only be used via the {pair} keyword of the "run_style
|
||||
respa"_run_style.html command. They do not support the {inner},
|
||||
{middle}, {outer} keywords.
|
||||
|
||||
[Restrictions:]
|
||||
|
||||
The {pair sph/idealgas} style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the "Making LAMMPS"_Section_start.html#2_3 section for
|
||||
more info.
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"pair_coeff"_pair_coeff.html, pair_sph/rhosum
|
||||
|
||||
[Default:] none
|
||||
|
||||
[(Monaghan1983)] J. J. Monaghan and R. A. Gingold, “Shock simulation by the particle method SPH,” Journal of Computational Physics, vol. 52, no. 2, pp. 374-389, Nov. 1983.
|
||||
|
|
@ -0,0 +1,72 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>pair_style sph/lj command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>pair_style sph/lj
|
||||
</PRE>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<P>pair_style sph/lj
|
||||
pair_coeff * * 1.0 2.4
|
||||
</P>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>The sph/lj style computes pressure forces between particles according to
|
||||
the Lennard-Jones equation of state, which is computed according to
|
||||
Ree's 1980 polynomial fit (Ree1980). The Lennard-Jones parameters
|
||||
$\epsilon$ and $\sigma$ are set to unity. This pair style also computes
|
||||
Monaghan's artificial viscosity to prevent particles from
|
||||
interpentrating (Monaghan1983).
|
||||
</P>
|
||||
<P>The following coefficients must be defined for each pair of atoms
|
||||
types via the <A HREF = "pair_coeff.html">pair_coeff</A> command as in the examples
|
||||
above.
|
||||
</P>
|
||||
<P>nu artificial viscosity (no units)
|
||||
h kernel function cutoff (distance units)
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<P><B>Mixing, shift, table, tail correction, restart, rRESPA info</B>:
|
||||
</P>
|
||||
<P>These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly.
|
||||
</P>
|
||||
<P>This style does not write information to <A HREF = "restart.html">binary restart
|
||||
files</A>, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
</P>
|
||||
<P>These styles can only be used via the <I>pair</I> keyword of the <A HREF = "run_style.html">run_style
|
||||
respa</A> command. They do not support the <I>inner</I>,
|
||||
<I>middle</I>, <I>outer</I> keywords.
|
||||
</P>
|
||||
<P><B>Restrictions:</B>
|
||||
The Lennard-Jones parameters $\epsilon$ and $\sigma$ are set to unity.
|
||||
The <I>pair sph/lj</I> style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the <A HREF = "Section_start.html#2_3">Making LAMMPS</A> section for
|
||||
more info.
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "pair_coeff.html">pair_coeff</A>, pair_sph/rhosum
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
<P><B>(Ree1980)</B> F. H. Ree. Analytic representation of thermodynamic data for the Lennard-Jones fluid.
|
||||
The Journal of Chemical Physics, 73(10):5401, 1980.
|
||||
</P>
|
||||
<P><B>(Monaghan1983)</B> J. J. Monaghan and R. A. Gingold, “Shock simulation by the particle method SPH,” Journal of Computational Physics, vol. 52, no. 2, pp. 374-389, Nov. 1983.
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,70 @@
|
|||
"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
|
||||
|
||||
pair_style sph/lj command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
pair_style sph/lj :pre
|
||||
|
||||
[Examples:]
|
||||
|
||||
pair_style sph/lj
|
||||
pair_coeff * * 1.0 2.4
|
||||
|
||||
[Description:]
|
||||
|
||||
The sph/lj style computes pressure forces between particles according to
|
||||
the Lennard-Jones equation of state, which is computed according to
|
||||
Ree's 1980 polynomial fit (Ree1980). The Lennard-Jones parameters
|
||||
$\epsilon$ and $\sigma$ are set to unity. This pair style also computes
|
||||
Monaghan's artificial viscosity to prevent particles from
|
||||
interpentrating (Monaghan1983).
|
||||
|
||||
|
||||
The following coefficients must be defined for each pair of atoms
|
||||
types via the "pair_coeff"_pair_coeff.html command as in the examples
|
||||
above.
|
||||
|
||||
nu artificial viscosity (no units)
|
||||
h kernel function cutoff (distance units)
|
||||
|
||||
:line
|
||||
|
||||
[Mixing, shift, table, tail correction, restart, rRESPA info]:
|
||||
|
||||
These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly.
|
||||
|
||||
This style does not write information to "binary restart
|
||||
files"_restart.html, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
|
||||
These styles can only be used via the {pair} keyword of the "run_style
|
||||
respa"_run_style.html command. They do not support the {inner},
|
||||
{middle}, {outer} keywords.
|
||||
|
||||
[Restrictions:]
|
||||
The Lennard-Jones parameters $\epsilon$ and $\sigma$ are set to unity.
|
||||
The {pair sph/lj} style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the "Making LAMMPS"_Section_start.html#2_3 section for
|
||||
more info.
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"pair_coeff"_pair_coeff.html, pair_sph/rhosum
|
||||
|
||||
[Default:] none
|
||||
|
||||
[(Ree1980)] F. H. Ree. Analytic representation of thermodynamic data for the Lennard-Jones fluid.
|
||||
The Journal of Chemical Physics, 73(10):5401, 1980.
|
||||
|
||||
[(Monaghan1983)] J. J. Monaghan and R. A. Gingold, “Shock simulation by the particle method SPH,” Journal of Computational Physics, vol. 52, no. 2, pp. 374-389, Nov. 1983.
|
||||
|
||||
|
|
@ -0,0 +1,64 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>pair_style sph/rhosum command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>pair_style sph/rhosum nstep
|
||||
</PRE>
|
||||
<P>nstep = timestep interval
|
||||
</P>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<P>pair_style sph/rhosum 10
|
||||
pair_coeff * * 2.4
|
||||
</P>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>The sph/rhosum style computes the local particle mass density rho by kernel function interpolation,
|
||||
see the SPH-USER documentation.
|
||||
</P>
|
||||
<P>The following coefficients must be defined for each pair of atoms
|
||||
types via the <A HREF = "pair_coeff.html">pair_coeff</A> command as in the examples
|
||||
above.
|
||||
</P>
|
||||
<P>h (distance units)
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<P><B>Mixing, shift, table, tail correction, restart, rRESPA info</B>:
|
||||
</P>
|
||||
<P>These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly.
|
||||
</P>
|
||||
<P>This style does not write information to <A HREF = "restart.html">binary restart
|
||||
files</A>, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
</P>
|
||||
<P>These styles can only be used via the <I>pair</I> keyword of the <A HREF = "run_style.html">run_style
|
||||
respa</A> command. They do not support the <I>inner</I>,
|
||||
<I>middle</I>, <I>outer</I> keywords.
|
||||
</P>
|
||||
<P><B>Restrictions:</B>
|
||||
</P>
|
||||
<P>The <I>pair sph/rhosum</I> style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the <A HREF = "Section_start.html#2_3">Making LAMMPS</A> section for
|
||||
more info.
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "pair_coeff.html">pair_coeff</A>, pair_sph/taitwater
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,59 @@
|
|||
"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
|
||||
|
||||
pair_style sph/rhosum command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
pair_style sph/rhosum nstep :pre
|
||||
|
||||
nstep = timestep interval
|
||||
|
||||
[Examples:]
|
||||
|
||||
pair_style sph/rhosum 10
|
||||
pair_coeff * * 2.4
|
||||
|
||||
[Description:]
|
||||
|
||||
The sph/rhosum style computes the local particle mass density rho by kernel function interpolation,
|
||||
see the SPH-USER documentation.
|
||||
|
||||
The following coefficients must be defined for each pair of atoms
|
||||
types via the "pair_coeff"_pair_coeff.html command as in the examples
|
||||
above.
|
||||
|
||||
h (distance units)
|
||||
|
||||
:line
|
||||
|
||||
[Mixing, shift, table, tail correction, restart, rRESPA info]:
|
||||
|
||||
These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly.
|
||||
|
||||
This style does not write information to "binary restart
|
||||
files"_restart.html, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
|
||||
These styles can only be used via the {pair} keyword of the "run_style
|
||||
respa"_run_style.html command. They do not support the {inner},
|
||||
{middle}, {outer} keywords.
|
||||
|
||||
[Restrictions:]
|
||||
|
||||
The {pair sph/rhosum} style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the "Making LAMMPS"_Section_start.html#2_3 section for
|
||||
more info.
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"pair_coeff"_pair_coeff.html, pair_sph/taitwater
|
||||
|
||||
[Default:] none
|
|
@ -0,0 +1,72 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>pair_style sph/taitwater command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>pair_style sph/taitwater
|
||||
</PRE>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<P>pair_style sph/taitwater
|
||||
pair_coeff * * 1000.0 1430.0 1.0 2.4
|
||||
</P>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>The sph/taitwater style computes pressure forces between particles according to Tait's equation of state,
|
||||
\begin<I>equation</I>
|
||||
p = B <B>(\frac<I>\rho</I><I>\rho_0</I>)^<I>\gamma</I> - 1</B>,
|
||||
\end<I>equation</I>
|
||||
where $\gamma=7$ and $B=c_0^2 \rho_0 / \gamma$, with $\rho_0$ being the reference density and $c_0$ the reference speed of sound.
|
||||
This pair style also computes Monaghan's artificial viscosity to prevent particles from interpentrating (Monaghan1983).
|
||||
</P>
|
||||
<P>The following coefficients must be defined for each pair of atoms
|
||||
types via the <A HREF = "pair_coeff.html">pair_coeff</A> command as in the examples
|
||||
above.
|
||||
</P>
|
||||
<P>rho0 reference density (mass/volume units)
|
||||
c0 reference soundspeed (distance/time units)
|
||||
nu artificial viscosity (no units)
|
||||
h kernel function cutoff (distance units)
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<P><B>Mixing, shift, table, tail correction, restart, rRESPA info</B>:
|
||||
</P>
|
||||
<P>These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly. Additionally, because rho0 and c0 are defined on a per-type basis,
|
||||
an I,I as well a J,J coefficients line must be specified prior to specifying an I,J interaction.
|
||||
</P>
|
||||
<P>This style does not write information to <A HREF = "restart.html">binary restart
|
||||
files</A>, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
</P>
|
||||
<P>These styles can only be used via the <I>pair</I> keyword of the <A HREF = "run_style.html">run_style
|
||||
respa</A> command. They do not support the <I>inner</I>,
|
||||
<I>middle</I>, <I>outer</I> keywords.
|
||||
</P>
|
||||
<P><B>Restrictions:</B>
|
||||
</P>
|
||||
<P>The <I>pair sph/taitwater</I> style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the <A HREF = "Section_start.html#2_3">Making LAMMPS</A> section for
|
||||
more info.
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "pair_coeff.html">pair_coeff</A>, pair_sph/rhosum
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
<P><B>(Monaghan1983)</B> J. J. Monaghan and R. A. Gingold, “Shock simulation by the particle method SPH,” Journal of Computational Physics, vol. 52, no. 2, pp. 374-389, Nov. 1983.
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,69 @@
|
|||
"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
|
||||
|
||||
pair_style sph/taitwater command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
pair_style sph/taitwater :pre
|
||||
|
||||
[Examples:]
|
||||
|
||||
pair_style sph/taitwater
|
||||
pair_coeff * * 1000.0 1430.0 1.0 2.4
|
||||
|
||||
[Description:]
|
||||
|
||||
The sph/taitwater style computes pressure forces between particles according to Tait's equation of state,
|
||||
\begin{equation}
|
||||
p = B [(\frac{\rho}{\rho_0})^{\gamma} - 1],
|
||||
\end{equation}
|
||||
where $\gamma=7$ and $B=c_0^2 \rho_0 / \gamma$, with $\rho_0$ being the reference density and $c_0$ the reference speed of sound.
|
||||
This pair style also computes Monaghan's artificial viscosity to prevent particles from interpentrating (Monaghan1983).
|
||||
|
||||
|
||||
The following coefficients must be defined for each pair of atoms
|
||||
types via the "pair_coeff"_pair_coeff.html command as in the examples
|
||||
above.
|
||||
|
||||
rho0 reference density (mass/volume units)
|
||||
c0 reference soundspeed (distance/time units)
|
||||
nu artificial viscosity (no units)
|
||||
h kernel function cutoff (distance units)
|
||||
|
||||
:line
|
||||
|
||||
[Mixing, shift, table, tail correction, restart, rRESPA info]:
|
||||
|
||||
These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly. Additionally, because rho0 and c0 are defined on a per-type basis,
|
||||
an I,I as well a J,J coefficients line must be specified prior to specifying an I,J interaction.
|
||||
|
||||
This style does not write information to "binary restart
|
||||
files"_restart.html, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
|
||||
These styles can only be used via the {pair} keyword of the "run_style
|
||||
respa"_run_style.html command. They do not support the {inner},
|
||||
{middle}, {outer} keywords.
|
||||
|
||||
[Restrictions:]
|
||||
|
||||
The {pair sph/taitwater} style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the "Making LAMMPS"_Section_start.html#2_3 section for
|
||||
more info.
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"pair_coeff"_pair_coeff.html, pair_sph/rhosum
|
||||
|
||||
[Default:] none
|
||||
|
||||
[(Monaghan1983)] J. J. Monaghan and R. A. Gingold, “Shock simulation by the particle method SPH,” Journal of Computational Physics, vol. 52, no. 2, pp. 374-389, Nov. 1983.
|
||||
|
|
@ -0,0 +1,72 @@
|
|||
<HTML>
|
||||
<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>
|
||||
</CENTER>
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
|
||||
<HR>
|
||||
|
||||
<H3>pair_style sph/taitwater/morris command
|
||||
</H3>
|
||||
<P><B>Syntax:</B>
|
||||
</P>
|
||||
<PRE>pair_style sph/taitwater/morris
|
||||
</PRE>
|
||||
<P><B>Examples:</B>
|
||||
</P>
|
||||
<P>pair_style sph/taitwater/morris
|
||||
pair_coeff * * 1000.0 1430.0 1.0 2.4
|
||||
</P>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
<P>The sph/taitwater/morris style computes pressure forces between particles according to Tait's equation of state,
|
||||
\begin<I>equation</I>
|
||||
p = B <B>(\frac<I>\rho</I><I>\rho_0</I>)^<I>\gamma</I> - 1</B>,
|
||||
\end<I>equation</I>
|
||||
where $\gamma=7$ and $B=c_0^2 \rho_0 / \gamma$, with $\rho_0$ being the reference density and $c_0$ the reference speed of sound.
|
||||
This pair style also computes laminar viscosity (Morris1997).
|
||||
</P>
|
||||
<P>The following coefficients must be defined for each pair of atoms
|
||||
types via the <A HREF = "pair_coeff.html">pair_coeff</A> command as in the examples
|
||||
above.
|
||||
</P>
|
||||
<P>rho0 reference density (mass/volume units)
|
||||
c0 reference soundspeed (distance/time units)
|
||||
nu dynamic viscosity (mass*distance/time units)
|
||||
h kernel function cutoff (distance units)
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<P><B>Mixing, shift, table, tail correction, restart, rRESPA info</B>:
|
||||
</P>
|
||||
<P>These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly. Additionally, because rho0 and c0 are defined on a per-type basis,
|
||||
an I,I as well a J,J coefficients line must be specified prior to specifying an I,J interaction.
|
||||
</P>
|
||||
<P>This style does not write information to <A HREF = "restart.html">binary restart
|
||||
files</A>, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
</P>
|
||||
<P>These styles can only be used via the <I>pair</I> keyword of the <A HREF = "run_style.html">run_style
|
||||
respa</A> command. They do not support the <I>inner</I>,
|
||||
<I>middle</I>, <I>outer</I> keywords.
|
||||
</P>
|
||||
<P><B>Restrictions:</B>
|
||||
</P>
|
||||
<P>The <I>pair sph/taitwater/morris</I> style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the <A HREF = "Section_start.html#2_3">Making LAMMPS</A> section for
|
||||
more info.
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "pair_coeff.html">pair_coeff</A>, pair_sph/rhosum
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
<P><B>(Morris1997)</B> J.P. Morris, P.J. Fox, and Y. Zhu. Modeling Low Reynolds Number Incompressible Flows Using SPH. Journal of Computational Physics, 136:214–226, 1997.
|
||||
</P>
|
||||
</HTML>
|
|
@ -0,0 +1,70 @@
|
|||
"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
|
||||
|
||||
pair_style sph/taitwater/morris command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
pair_style sph/taitwater/morris :pre
|
||||
|
||||
[Examples:]
|
||||
|
||||
pair_style sph/taitwater/morris
|
||||
pair_coeff * * 1000.0 1430.0 1.0 2.4
|
||||
|
||||
[Description:]
|
||||
|
||||
The sph/taitwater/morris style computes pressure forces between particles according to Tait's equation of state,
|
||||
\begin{equation}
|
||||
p = B [(\frac{\rho}{\rho_0})^{\gamma} - 1],
|
||||
\end{equation}
|
||||
where $\gamma=7$ and $B=c_0^2 \rho_0 / \gamma$, with $\rho_0$ being the reference density and $c_0$ the reference speed of sound.
|
||||
This pair style also computes laminar viscosity (Morris1997).
|
||||
|
||||
|
||||
The following coefficients must be defined for each pair of atoms
|
||||
types via the "pair_coeff"_pair_coeff.html command as in the examples
|
||||
above.
|
||||
|
||||
rho0 reference density (mass/volume units)
|
||||
c0 reference soundspeed (distance/time units)
|
||||
nu dynamic viscosity (mass*distance/time units)
|
||||
h kernel function cutoff (distance units)
|
||||
|
||||
:line
|
||||
|
||||
[Mixing, shift, table, tail correction, restart, rRESPA info]:
|
||||
|
||||
These pair styles do not support mixing. Thus, coefficients for all
|
||||
I,J pairs must be specified explicitly. Additionally, because rho0 and c0 are defined on a per-type basis,
|
||||
an I,I as well a J,J coefficients line must be specified prior to specifying an I,J interaction.
|
||||
|
||||
This style does not write information to "binary restart
|
||||
files"_restart.html, so pair_style and pair_coeff commands do need
|
||||
to be specified in an input script that reads a restart file.
|
||||
|
||||
These styles can only be used via the {pair} keyword of the "run_style
|
||||
respa"_run_style.html command. They do not support the {inner},
|
||||
{middle}, {outer} keywords.
|
||||
|
||||
[Restrictions:]
|
||||
|
||||
The {pair sph/taitwater/morris} style is part of the "USER-SPH" package. It is
|
||||
only enabled if LAMMPS was built with that package (which it is by
|
||||
default). See the "Making LAMMPS"_Section_start.html#2_3 section for
|
||||
more info.
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"pair_coeff"_pair_coeff.html, pair_sph/rhosum
|
||||
|
||||
[Default:] none
|
||||
|
||||
[(Morris1997)] J.P. Morris, P.J. Fox, and Y. Zhu. Modeling Low Reynolds Number Incompressible Flows Using SPH. Journal of Computational Physics, 136:214–226, 1997.
|
||||
|
||||
|
Loading…
Reference in New Issue