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sjplimp 2016-05-09 20:13:19 +00:00
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158 changed files with 219 additions and 223 deletions
doc/html
Section_commands.htmlSection_modify.htmlchange_box.htmlcompute_angle.htmlcompute_angle_local.htmlcompute_angmom_chunk.htmlcompute_body_local.htmlcompute_bond.htmlcompute_bond_local.htmlcompute_chunk_atom.htmlcompute_com.htmlcompute_com_chunk.htmlcompute_dihedral.htmlcompute_dipole_chunk.htmlcompute_displace_atom.htmlcompute_dpd.htmlcompute_dpd_atom.htmlcompute_erotate_asphere.htmlcompute_erotate_rigid.htmlcompute_erotate_sphere.htmlcompute_erotate_sphere_atom.htmlcompute_group_group.htmlcompute_gyration.htmlcompute_gyration_chunk.htmlcompute_heat_flux.htmlcompute_improper.htmlcompute_inertia_chunk.htmlcompute_ke.htmlcompute_ke_atom.htmlcompute_ke_atom_eff.htmlcompute_ke_eff.htmlcompute_ke_rigid.htmlcompute_meso_e_atom.htmlcompute_meso_rho_atom.htmlcompute_meso_t_atom.htmlcompute_msd.htmlcompute_msd_chunk.htmlcompute_msd_nongauss.htmlcompute_omega_chunk.htmlcompute_pair.htmlcompute_pair_local.htmlcompute_pe.htmlcompute_pe_atom.htmlcompute_pressure.htmlcompute_property_atom.htmlcompute_property_chunk.htmlcompute_rdf.htmlcompute_reduce.htmlcompute_slice.htmlcompute_smd_contact_radius.htmlcompute_smd_hourglass_error.htmlcompute_smd_internal_energy.htmlcompute_smd_plastic_strain.htmlcompute_smd_plastic_strain_rate.htmlcompute_smd_rho.htmlcompute_smd_tlsph_defgrad.htmlcompute_smd_tlsph_dt.htmlcompute_smd_tlsph_num_neighs.htmlcompute_smd_tlsph_strain.htmlcompute_smd_tlsph_strain_rate.htmlcompute_smd_tlsph_stress.htmlcompute_smd_triangle_mesh_vertices.htmlcompute_smd_ulsph_num_neighs.htmlcompute_smd_ulsph_strain.htmlcompute_smd_ulsph_strain_rate.htmlcompute_smd_ulsph_stress.htmlcompute_smd_vol.htmlcompute_stress_atom.htmlcompute_temp.htmlcompute_temp_asphere.htmlcompute_temp_body.htmlcompute_temp_chunk.htmlcompute_temp_com.htmlcompute_temp_cs.htmlcompute_temp_deform.htmlcompute_temp_deform_eff.htmlcompute_temp_partial.htmlcompute_temp_profile.htmlcompute_temp_ramp.htmlcompute_temp_region.htmlcompute_temp_region_eff.htmlcompute_temp_rotate.htmlcompute_temp_sphere.htmlcompute_ti.htmlcompute_torque_chunk.htmlcompute_vacf.htmlcompute_vcm_chunk.htmlcompute_voronoi_atom.htmlcreate_atoms.htmldisplace_atoms.htmldump.htmldump_custom_vtk.htmldump_image.htmldump_modify.htmlfix_append_atoms.htmlfix_ave_chunk.htmlfix_ave_spatial.htmlfix_ave_spatial_sphere.htmlfix_deform.htmlfix_deposit.html

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@ -335,7 +335,7 @@ commands need only be used if a non-default value is desired.</p>
</ol>
<p>Set parameters that need to be defined before atoms are created or
read-in from a file.</p>
<p>The relevant commands are <a class="reference internal" href="units.html"><span class="doc">units</span></a>,
<p>The relevant commands are <span class="xref doc">units</span>,
<a class="reference internal" href="dimension.html"><span class="doc">dimension</span></a>, <a class="reference internal" href="newton.html"><span class="doc">newton</span></a>,
<a class="reference internal" href="processors.html"><span class="doc">processors</span></a>, <a class="reference internal" href="boundary.html"><span class="doc">boundary</span></a>,
<a class="reference internal" href="atom_style.html"><span class="doc">atom_style</span></a>, <a class="reference internal" href="atom_modify.html"><span class="doc">atom_modify</span></a>.</p>
@ -404,7 +404,7 @@ in the command&#8217;s documentation.</p>
<p>Initialization:</p>
<p><a class="reference internal" href="atom_modify.html"><span class="doc">atom_modify</span></a>, <a class="reference internal" href="atom_style.html"><span class="doc">atom_style</span></a>,
<a class="reference internal" href="boundary.html"><span class="doc">boundary</span></a>, <a class="reference internal" href="dimension.html"><span class="doc">dimension</span></a>,
<a class="reference internal" href="newton.html"><span class="doc">newton</span></a>, <a class="reference internal" href="processors.html"><span class="doc">processors</span></a>, <a class="reference internal" href="units.html"><span class="doc">units</span></a></p>
<a class="reference internal" href="newton.html"><span class="doc">newton</span></a>, <a class="reference internal" href="processors.html"><span class="doc">processors</span></a>, <span class="xref doc">units</span></p>
<p>Atom definition:</p>
<p><a class="reference internal" href="create_atoms.html"><span class="doc">create_atoms</span></a>, <a class="reference internal" href="create_box.html"><span class="doc">create_box</span></a>,
<a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a>, <a class="reference internal" href="read_data.html"><span class="doc">read_data</span></a>,
@ -575,7 +575,7 @@ in the command&#8217;s documentation.</p>
<td><a class="reference internal" href="undump.html"><span class="doc">undump</span></a></td>
<td><a class="reference internal" href="unfix.html"><span class="doc">unfix</span></a></td>
</tr>
<tr class="row-even"><td><a class="reference internal" href="units.html"><span class="doc">units</span></a></td>
<tr class="row-even"><td><span class="xref doc">units</span></td>
<td><a class="reference internal" href="variable.html"><span class="doc">variable</span></a></td>
<td><a class="reference internal" href="velocity.html"><span class="doc">velocity</span></a></td>
<td><a class="reference internal" href="write_coeff.html"><span class="doc">write_coeff</span></a></td>

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@ -254,7 +254,7 @@ parallel. E.g. don&#8217;t accumulate a bunch of data on a single processor
and analyze it. You run the risk of seriously degrading the parallel
efficiency.</li>
<li>If your new feature reads arguments or writes output, make sure you
follow the unit conventions discussed by the <a class="reference internal" href="units.html"><span class="doc">units</span></a>
follow the unit conventions discussed by the <span class="xref doc">units</span>
command.</li>
<li>If you add something you think is truly useful and doesn&#8217;t impact
LAMMPS performance when it isn&#8217;t used, send an email to the

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@ -409,7 +409,7 @@ including this one, have been processed.</p>
<hr class="docutils" />
<p>The <em>units</em> keyword determines the meaning of the distance units used
to define various arguments. A <em>box</em> value selects standard distance
units as defined by the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command, e.g. Angstroms for
units as defined by the <span class="xref doc">units</span> command, e.g. Angstroms for
units = real or metal. A <em>lattice</em> value means the distance units are
in lattice spacings. The <a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a> command must have
been previously used to define the lattice spacing.</p>

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@ -158,7 +158,7 @@ number of sub_styles defined by the <a class="reference internal" href="angle_st
or vector values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector values are &#8220;extensive&#8221; and will be in energy
<a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -181,7 +181,7 @@ keywords. The vector or array can be accessed by any command that
uses local values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The output for <em>theta</em> will be in degrees. The output for <em>eng</em> will
be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -191,7 +191,7 @@ These values can be accessed by any command that uses global array
values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The array values are &#8220;intensive&#8221;. The array values will be in
mass-velocity-distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
mass-velocity-distance <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -196,7 +196,7 @@ specified, a local array is produced where the number of columns = the
number of keywords. The vector or array can be accessed by any
command that uses local values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The <a class="reference internal" href="units.html"><span class="doc">units</span></a> for output values depend on the body style.</p>
<p>The <span class="xref doc">units</span> for output values depend on the body style.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -158,7 +158,7 @@ These values can be used by any command that uses global scalar or
vector values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector values are &#8220;extensive&#8221; and will be in energy
<a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -187,9 +187,9 @@ local array is produced where the number of columns = the number of
keywords. The vector or array can be accessed by any command that
uses local values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The output for <em>dist</em> will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
output for <em>eng</em> will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The output for
<em>force</em> will be in force <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The output for <em>dist</em> will be in distance <span class="xref doc">units</span>. The
output for <em>eng</em> will be in energy <span class="xref doc">units</span>. The output for
<em>force</em> will be in force <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -644,7 +644,7 @@ and <em>crmax</em>.</p>
be used. For non-orthogonal (triclinic) simulation boxes, only the
<em>reduced</em> option may be used.</p>
<p>A <em>box</em> value selects standard distance units as defined by the
<a class="reference internal" href="units.html"><span class="doc">units</span></a> command, e.g. Angstroms for units = real or metal.
<span class="xref doc">units</span> command, e.g. Angstroms for units = real or metal.
A <em>lattice</em> value means the distance units are in lattice spacings.
The <a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a> command must have been previously used to
define the lattice spacing. A <em>reduced</em> value means normalized

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@ -165,7 +165,7 @@ accessed by indices 1-3 by any command that uses global vector values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector values are &#8220;intensive&#8221;. The vector values will be in
distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
distance <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -189,7 +189,7 @@ values can be accessed by any command that uses global array values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The array values are &#8220;intensive&#8221;. The array values will be in
distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
distance <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -157,7 +157,7 @@ number of sub_styles defined by the <a class="reference internal" href="dihedral
or vector values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector values are &#8220;extensive&#8221; and will be in energy
<a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -194,7 +194,7 @@ chunk. These values can be accessed by any command that uses global
array values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The array values are &#8220;intensive&#8221;. The array values will be in
dipole units, i.e. charge units times distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
dipole units, i.e. charge units times distance <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -177,7 +177,7 @@ correctly with time=0 atom coordinates from the restart file.</p>
accessed by indices 1-4 by any command that uses per-atom values from
a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The per-atom array values will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-atom array values will be in distance <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -160,7 +160,7 @@ relations:</p>
U, dpdTheta, N_particles), which can be accessed by indices 1-5. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS
output options.</p>
<p>The vector values will be in energy and temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The vector values will be in energy and temperature <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -156,7 +156,7 @@ that uses per-particle values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-particle array values will be in energy (u_cond, u_mech) and
temperature (dpdTheta) <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
temperature (dpdTheta) <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -165,7 +165,7 @@ used by any command that uses a global scalar value from a compute as
input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an
overview of LAMMPS output options.</p>
<p>The scalar value calculated by this compute is &#8220;extensive&#8221;. The
scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
scalar value will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -163,7 +163,7 @@ uses a global scalar value from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The scalar value calculated by this compute is &#8220;extensive&#8221;. The
scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
scalar value will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -160,7 +160,7 @@ used by any command that uses a global scalar value from a compute as
input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an
overview of LAMMPS output options.</p>
<p>The scalar value calculated by this compute is &#8220;extensive&#8221;. The
scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
scalar value will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -162,7 +162,7 @@ in the specified compute group or for point particles with a radius =
any command that uses per-atom values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-atom vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-atom vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -213,8 +213,8 @@ These values can be used by any command that uses global scalar or
vector values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>Both the scalar and vector values calculated by this compute are
&#8220;extensive&#8221;. The scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.
The vector values will be in force <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
&#8220;extensive&#8221;. The scalar value will be in energy <span class="xref doc">units</span>.
The vector values will be in force <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -177,7 +177,7 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar and vector values calculated by this compute are
&#8220;intensive&#8221;. The scalar and vector values will be in distance and
distance^2 <a class="reference internal" href="units.html"><span class="doc">units</span></a> respectively.</p>
distance^2 <span class="xref doc">units</span> respectively.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -209,7 +209,7 @@ input. See <a class="reference internal" href="Section_howto.html#howto-15"><sp
of LAMMPS output options.</p>
<p>All the vector or array values calculated by this compute are
&#8220;intensive&#8221;. The vector or array values will be in distance
<a class="reference internal" href="units.html"><span class="doc">units</span></a>, since they are the square root of values
<span class="xref doc">units</span>, since they are the square root of values
represented by the formula above.</p>
</div>
<div class="section" id="restrictions">

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@ -212,9 +212,9 @@ the simulation. Note that if the compute is &#8220;all&#8221;, then the
appropriate volume to divide by is the simulation box volume.
However, if a sub-group is used, it should be the volume containing
those atoms.</p>
<p>The vector values will be in energy*velocity <a class="reference internal" href="units.html"><span class="doc">units</span></a>. Once
<p>The vector values will be in energy*velocity <span class="xref doc">units</span>. Once
divided by a volume the units will be that of flux, namely
energy/area/time <a class="reference internal" href="units.html"><span class="doc">units</span></a></p>
energy/area/time <span class="xref doc">units</span></p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -157,7 +157,7 @@ number of sub_styles defined by the <a class="reference internal" href="improper
or vector values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector values are &#8220;extensive&#8221; and will be in energy
<a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -190,7 +190,7 @@ as listed above. These values can be accessed by any command that
uses global array values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The array values are &#8220;intensive&#8221;. The array values will be in
mass*distance^2 <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
mass*distance^2 <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -166,7 +166,7 @@ can be used by any command that uses a global scalar value from a
compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a>
for an overview of LAMMPS output options.</p>
<p>The scalar value calculated by this compute is &#8220;extensive&#8221;. The
scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
scalar value will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -155,7 +155,7 @@ specified compute group.</p>
any command that uses per-atom values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-atom vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-atom vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -180,7 +180,7 @@ electrons) not in the specified compute group.</p>
accessed by any command that uses per-atom computes as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-atom vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-atom vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -181,7 +181,7 @@ used by any command that uses a global scalar value from a compute as
input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an
overview of LAMMPS output options.</p>
<p>The scalar value calculated by this compute is &#8220;extensive&#8221;. The
scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
scalar value will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -161,7 +161,7 @@ rigid bodies). This value can be used by any command that uses a
global scalar value from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The scalar value calculated by this compute is &#8220;extensive&#8221;. The
scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
scalar value will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -158,7 +158,7 @@ specified compute group.</p>
any command that uses per-atom values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-atom vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-atom vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -158,7 +158,7 @@ specified compute group.</p>
any command that uses per-atom values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-atom vector values will be in mass/volume <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-atom vector values will be in mass/volume <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -159,7 +159,7 @@ specified compute group.</p>
any command that uses per-atom values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-atom vector values will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-atom vector values will be in temperature <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -215,7 +215,7 @@ accessed by indices 1-4 by any command that uses global vector values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector values are &#8220;intensive&#8221;. The vector values will be in
distance^2 <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
distance^2 <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -226,7 +226,7 @@ accessed by any command that uses global array values from a compute
as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an
overview of LAMMPS output options.</p>
<p>The array values are &#8220;intensive&#8221;. The array values will be in
distance^2 <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
distance^2 <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -177,7 +177,7 @@ accessed by indices 1-3 by any command that uses global vector values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector values are &#8220;intensive&#8221;. The first vector value will be in
distance^2 <a class="reference internal" href="units.html"><span class="doc">units</span></a>, the second is in distance^4 units, and
distance^2 <span class="xref doc">units</span>, the second is in distance^4 units, and
the 3rd is dimensionless.</p>
</div>
<div class="section" id="restrictions">

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@ -191,7 +191,7 @@ These values can be accessed by any command that uses global array
values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The array values are &#8220;intensive&#8221;. The array values will be in
velocity/distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
velocity/distance <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -185,8 +185,8 @@ from a compute as input. See <a class="reference internal" href="Section_howto.
options.</p>
<p>The scalar and vector values calculated by this compute are
&#8220;extensive&#8221;.</p>
<p>The scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The vector
values will typically also be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>, but see
<p>The scalar value will be in energy <span class="xref doc">units</span>. The vector
values will typically also be in energy <span class="xref doc">units</span>, but see
the doc page for the pair style for details.</p>
</div>
<div class="section" id="restrictions">

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@ -179,9 +179,9 @@ example of ones that do are the <a class="reference internal" href="pair_gran.ht
which calculate the tangential force between two particles and return
its components and magnitude acting on atom I for N = 1,2,3,4. See
individual pair styles for detils.</p>
<p>The output <em>dist</em> will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The output
<em>eng</em> will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The outputs <em>force</em>,
<em>fx</em>, <em>fy</em>, and <em>fz</em> will be in force <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The output
<p>The output <em>dist</em> will be in distance <span class="xref doc">units</span>. The output
<em>eng</em> will be in energy <span class="xref doc">units</span>. The outputs <em>force</em>,
<em>fx</em>, <em>fy</em>, and <em>fz</em> will be in force <span class="xref doc">units</span>. The output
<em>pN</em> will be in whatever units the pair style defines.</p>
<p>Note that as atoms migrate from processor to processor, there will be
no consistent ordering of the entries within the local vector or array
@ -217,9 +217,9 @@ local array is produced where the number of columns = the number of
keywords. The vector or array can be accessed by any command that
uses local values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The output for <em>dist</em> will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
output for <em>eng</em> will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The output for
<em>force</em> will be in force <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The output for <em>dist</em> will be in distance <span class="xref doc">units</span>. The
output for <em>eng</em> will be in energy <span class="xref doc">units</span>. The output for
<em>force</em> will be in force <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -200,7 +200,7 @@ value can be used by any command that uses a global scalar value from
a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The scalar value calculated by this compute is &#8220;extensive&#8221;. The
scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
scalar value will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -191,7 +191,7 @@ those are global contributions to the system energy.</p>
any command that uses per-atom values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-atom vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-atom vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -229,7 +229,7 @@ or vector values from a compute as input. See <a class="reference internal" hre
options.</p>
<p>The scalar and vector values calculated by this compute are
&#8220;intensive&#8221;. The scalar and vector values will be in pressure
<a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -262,7 +262,7 @@ per-atom array is produced where the number of columns = the number of
inputs. The vector or array can be accessed by any command that uses
per-atom values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector or array values will be in whatever <a class="reference internal" href="units.html"><span class="doc">units</span></a> the
<p>The vector or array values will be in whatever <span class="xref doc">units</span> the
corresponding attribute is in, e.g. velocity units for vx, charge
units for q, etc.</p>
</div>

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@ -186,7 +186,7 @@ is the center point of the bin in the corresponding dimension. Style
<em>bin/1d</em> only defines a <em>coord1</em> attribute. Style <em>bin/2d</em> adds a
<em>coord2</em> attribute. Style <em>bin/3d</em> adds a <em>coord3</em> attribute.</p>
<p>Note that if the value of the <em>units</em> keyword used in the <a class="reference internal" href="compute_chunk_atom.html"><span class="doc">compute chunk/atom command</span></a> is <em>box</em> or <em>lattice</em>, the
<em>coordN</em> attributes will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>. If the
<em>coordN</em> attributes will be in distance <span class="xref doc">units</span>. If the
value of the <em>units</em> keyword is <em>reduced</em>, the <em>coordN</em> attributes
will be in unitless reduced units (0-1).</p>
<p>The simplest way to output the results of the compute property/chunk

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@ -242,7 +242,7 @@ by any command that uses a global values from a compute as input. See
LAMMPS output options.</p>
<p>The array values calculated by this compute are all &#8220;intensive&#8221;.</p>
<p>The first column of array values will be in distance
<a class="reference internal" href="units.html"><span class="doc">units</span></a>. The g(r) columns of array values are normalized
<span class="xref doc">units</span>. The g(r) columns of array values are normalized
numbers &gt;= 0.0. The coordination number columns of array values are
also numbers &gt;= 0.0.</p>
</div>

View File

@ -281,7 +281,7 @@ for an overview of LAMMPS output options.</p>
&#8220;intensive&#8221;, except when the <em>sum</em> or <em>sumsq</em> modes are used on
per-atom or local vectors, in which case the calculated values are
&#8220;extensive&#8221;.</p>
<p>The scalar or vector values will be in whatever <a class="reference internal" href="units.html"><span class="doc">units</span></a> the
<p>The scalar or vector values will be in whatever <span class="xref doc">units</span> the
quantities being reduced are in.</p>
</div>
<div class="section" id="restrictions">

View File

@ -220,7 +220,7 @@ array values calculated by this compute are &#8220;intensive&#8221;. If there a
multiple input vectors, and any value in them is extensive, then the
array values calculated by this compute are &#8220;extensive&#8221;. Values
produced by a variable are treated as intensive.</p>
<p>The vector or array values will be in whatever <a class="reference internal" href="units.html"><span class="doc">units</span></a> the
<p>The vector or array values will be in whatever <span class="xref doc">units</span> the
input quantities are in.</p>
</div>
<div class="section" id="restrictions">

View File

@ -158,7 +158,7 @@ specified compute group.</p>
any command that uses per-particle values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-particle vector values will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-particle vector values will be in distance <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -162,7 +162,7 @@ any command that uses per-particle values from a compute as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a>
for an overview of LAMMPS output options.</p>
<p>The per-particle vector values will are dimensionless. See
<a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -153,7 +153,7 @@ Mach Dynamics in LAMMPS.</p>
by any command that uses per-particle values from a compute as input.
See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for
an overview of LAMMPS output options.</p>
<p>The per-particle vector values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of energy.</p>
<p>The per-particle vector values will be given in <span class="xref doc">units</span> of energy.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -154,7 +154,7 @@ Mach Dynamics in LAMMPS.</p>
by any command that uses per-particle values from a compute as input.
See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for
an overview of LAMMPS output options.</p>
<p>The per-particle values will be given dimensionless. See <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-particle values will be given dimensionless. See <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

View File

@ -154,7 +154,7 @@ Mach Dynamics in LAMMPS.</p>
by any command that uses per-particle values from a compute as input.
See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for
an overview of LAMMPS output options.</p>
<p>The per-particle values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of one over time.</p>
<p>The per-particle values will be given in <span class="xref doc">units</span> of one over time.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

View File

@ -155,7 +155,7 @@ Mach Dynamics in LAMMPS.</p>
by any command that uses per-particle values from a compute as input.
See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for
an overview of LAMMPS output options.</p>
<p>The per-particle values will be in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of mass over volume.</p>
<p>The per-particle values will be in <span class="xref doc">units</span> of mass over volume.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -155,7 +155,7 @@ which can be accessed by any command that uses per-particle values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for an overview of LAMMPS output
options.</p>
<p>The per-particle vector values will be given dimensionless. See
<a class="reference internal" href="units.html"><span class="doc">units</span></a>. The per-particle vector has 10 entries. The first
<span class="xref doc">units</span>. The per-particle vector has 10 entries. The first
nine entries correspond to the xx, xy, xz, yx, yy, yz, zx, zy, zz
components of the asymmetric deformation gradient tensor. The tenth
entry is the determinant of the deformation gradient.</p>

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@ -159,7 +159,7 @@ Mach Dynamics in LAMMPS.</p>
by any command that uses per-particle values from a compute as input.
See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for
an overview of LAMMPS output options.</p>
<p>The per-particle values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of time.</p>
<p>The per-particle values will be given in <span class="xref doc">units</span> of time.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

View File

@ -154,7 +154,7 @@ Mach Dynamics in LAMMPS.</p>
by any command that uses per-particle values from a compute as input.
See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for
an overview of LAMMPS output options.</p>
<p>The per-particle values are dimensionless. See <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-particle values are dimensionless. See <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

View File

@ -154,7 +154,7 @@ which can be accessed by any command that uses per-particle values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for an overview of LAMMPS output
options.</p>
<p>The per-particle tensor values will be given dimensionless. See
<a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<span class="xref doc">units</span>.</p>
<p>The per-particle vector has 6 entries, corresponding to the xx, yy,
zz, xy, xz, yz components of the symmetric strain tensor.</p>
</div>

View File

@ -153,7 +153,7 @@ Mach Dynamics in LAMMPS.</p>
which can be accessed by any command that uses per-particle values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for an overview of LAMMPS output
options.</p>
<p>The values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of one over time.</p>
<p>The values will be given in <span class="xref doc">units</span> of one over time.</p>
<p>The per-particle vector has 6 entries, corresponding to the xx, yy,
zz, xy, xz, yz components of the symmetric strain rate tensor.</p>
</div>

View File

@ -154,7 +154,7 @@ accessed by any command that uses per-particle values from a compute
as input. See
<a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a>
for an overview of LAMMPS output options.</p>
<p>The values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of pressure.</p>
<p>The values will be given in <span class="xref doc">units</span> of pressure.</p>
<p>The per-particle vector has 7 entries. The first six entries
correspond to the xx, yy, zz, xy, xz and yz components of the
symmetric Cauchy stress tensor. The seventh entry is the second

View File

@ -161,7 +161,7 @@ which is created via the <a href="#id6"><span class="problematic" id="id7">`fix
<p>The output of this compute can be used with the dump2vtk_tris tool to
generate a VTK representation of the smd/wall_surace mesh for
visualization purposes.</p>
<p>The values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of distance.</p>
<p>The values will be given in <span class="xref doc">units</span> of distance.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

View File

@ -154,7 +154,7 @@ Mach Dynamics in LAMMPS.</p>
any command that uses per-particle values from a compute as input.
See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of
LAMMPS output options.</p>
<p>The per-particle values will be given dimentionless, see <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The per-particle values will be given dimentionless, see <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

View File

@ -156,7 +156,7 @@ LAMMPS output options.</p>
<p>The per-particle vector has 6 entries, corresponding to the xx, yy,
zz, xy, xz, yz components of the symmetric strain rate tensor.</p>
<p>The per-particle tensor values will be given dimensionless, see
<a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

View File

@ -154,7 +154,7 @@ Mach Dynamics in LAMMPS.</p>
which can be accessed by any command that uses per-particle values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of one over time.</p>
<p>The values will be given in <span class="xref doc">units</span> of one over time.</p>
<p>The per-particle vector has 6 entries, corresponding to the xx, yy,
zz, xy, xz, yz components of the symmetric strain rate tensor.</p>
</div>

View File

@ -152,7 +152,7 @@ Mach Dynamics in LAMMPS.</p>
which can be accessed by any command that uses per-particle values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of pressure.</p>
<p>The values will be given in <span class="xref doc">units</span> of pressure.</p>
<p>The per-particle vector has 7 entries. The first six entries
correspond to the xx, yy, zz, xy, xz, yz components of the symmetric
Cauchy stress tensor. The seventh entry is the second invariant of the

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@ -153,7 +153,7 @@ Mach Dynamics in LAMMPS.</p>
by any command that uses per-particle values from a compute as input.
See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">How-to discussions, section 6.15</span></a> for
an overview of LAMMPS output options.</p>
<p>The per-particle vector values will be given in <a class="reference internal" href="units.html"><span class="doc">units</span></a> of
<p>The per-particle vector values will be given in <span class="xref doc">units</span> of
volume.</p>
<p>Additionally, the compute returns a scalar, which is the sum of the
per-particle volumes of the group for which the fix is defined.</p>

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@ -246,7 +246,7 @@ accessed by indices 1-6 by any command that uses per-atom values from
a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The per-atom array values will be in pressure*volume
<a class="reference internal" href="units.html"><span class="doc">units</span></a> as discussed above.</p>
<span class="xref doc">units</span> as discussed above.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -207,8 +207,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -238,8 +238,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -219,8 +219,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -312,10 +312,10 @@ compute as input. Again, see <a class="reference internal" href="Section_howto.
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;. The array values are &#8220;intensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The array values
will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a> for the <em>temp</em> value, and in
energy <a class="reference internal" href="units.html"><span class="doc">units</span></a> for the <em>kecom</em> and <em>internal</em> values.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>. The array values
will be in temperature <span class="xref doc">units</span> for the <em>temp</em> value, and in
energy <span class="xref doc">units</span> for the <em>kecom</em> and <em>internal</em> values.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -189,8 +189,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -204,8 +204,8 @@ These values can be used by any command that uses global scalar or
vector values from a compute as input.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -229,8 +229,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -170,8 +170,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -209,8 +209,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -262,10 +262,10 @@ vector or array values from a compute as input. See <a class="reference interna
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;. The array values are &#8220;intensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The first column
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>. The first column
of array values are counts; the values in the second column will be in
temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
temperature <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -169,7 +169,7 @@ simulation, N = number of atoms in the group, k = Boltzmann constant,
and T = temperature.</p>
<p>The <em>units</em> keyword determines the meaning of the distance units used
for coordinates (c1,c2) and velocities (vlo,vhi). A <em>box</em> value
selects standard distance units as defined by the <a class="reference internal" href="units.html"><span class="doc">units</span></a>
selects standard distance units as defined by the <span class="xref doc">units</span>
command, e.g. Angstroms for units = real or metal. A <em>lattice</em> value
means the distance units are in lattice spacings; e.g. velocity =
lattice spacings / tau. The <a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a> command must have
@ -207,8 +207,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -202,8 +202,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -162,8 +162,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -188,8 +188,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -226,8 +226,8 @@ vector values from a compute as input. See <a class="reference internal" href="
options.</p>
<p>The scalar value calculated by this compute is &#8220;intensive&#8221;. The
vector values are &#8220;extensive&#8221;.</p>
<p>The scalar value will be in temperature <a class="reference internal" href="units.html"><span class="doc">units</span></a>. The
vector values will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in temperature <span class="xref doc">units</span>. The
vector values will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -226,7 +226,7 @@ value can be used by any command that uses a global scalar value from
a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The scalar value calculated by this compute is &#8220;extensive&#8221;.</p>
<p>The scalar value will be in energy <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
<p>The scalar value will be in energy <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -190,7 +190,7 @@ can be accessed by any command that uses global array values from a
compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a>
for an overview of LAMMPS output options.</p>
<p>The array values are &#8220;intensive&#8221;. The array values will be in
force-distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
force-distance <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -180,7 +180,7 @@ accessed by indices 1-4 by any command that uses global vector values
from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">this section</span></a> for an overview of LAMMPS output
options.</p>
<p>The vector values are &#8220;intensive&#8221;. The vector values will be in
velocity^2 <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
velocity^2 <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -180,7 +180,7 @@ These values can be accessed by any command that uses global array
values from a compute as input. See <a class="reference internal" href="Section_howto.html#howto-15"><span class="std std-ref">Section_howto 15</span></a> for an overview of LAMMPS output
options.</p>
<p>The array values are &#8220;intensive&#8221;. The array values will be in
velocity <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
velocity <span class="xref doc">units</span>.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -317,8 +317,8 @@ keyword to turn off the production of the per-atom quantities. For
the default value <em>yes</em> both quantities are produced. For the value
<em>no</em>, only the local array is produced.</p>
</div>
<p>The Voronoi cell volume will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a> cubed.
The Voronoi face area will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a> squared.</p>
<p>The Voronoi cell volume will be in distance <span class="xref doc">units</span> cubed.
The Voronoi face area will be in distance <span class="xref doc">units</span> squared.</p>
</div>
<div class="section" id="restrictions">
<h2>Restrictions</h2>

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@ -363,7 +363,7 @@ rotation.</p>
<p>The <em>units</em> keyword determines the meaning of the distance units used
to specify the coordinates of the one particle created by the <em>single</em>
style. A <em>box</em> value selects standard distance units as defined by
the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command, e.g. Angstroms for units = real or
the <span class="xref doc">units</span> command, e.g. Angstroms for units = real or
metal. A <em>lattice</em> value means the distance units are in lattice
spacings.</p>
<hr class="docutils" />

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@ -217,7 +217,7 @@ atom&#8217;s rotation.</p>
<p>Distance units for displacements and the origin point of the <em>rotate</em>
style are determined by the setting of <em>box</em> or <em>lattice</em> for the
<em>units</em> keyword. <em>Box</em> means distance units as defined by the
<a class="reference internal" href="units.html"><span class="doc">units</span></a> command - e.g. Angstroms for <em>real</em> units.
<span class="xref doc">units</span> command - e.g. Angstroms for <em>real</em> units.
<em>Lattice</em> means distance units are in lattice spacings. The
<a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a> command must have been previously used to
define the lattice spacing.</p>

View File

@ -587,7 +587,7 @@ mass. <em>Vx</em>, <em>vy</em>, <em>vz</em>, <em>fx</em>, <em>fy</em>, <em>fz</
atom velocity and force and atomic charge.</p>
<p>There are several options for outputting atom coordinates. The <em>x</em>,
<em>y</em>, <em>z</em> attributes write atom coordinates &#8220;unscaled&#8221;, in the
appropriate distance <a class="reference internal" href="units.html"><span class="doc">units</span></a> (Angstroms, sigma, etc). Use
appropriate distance <span class="xref doc">units</span> (Angstroms, sigma, etc). Use
<em>xs</em>, <em>ys</em>, <em>zs</em> if you want the coordinates &#8220;scaled&#8221; to the box size,
so that each value is 0.0 to 1.0. If the simulation box is triclinic
(tilted), then all atom coords will still be between 0.0 and 1.0. Use

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@ -312,7 +312,7 @@ atom type. <em>mass</em> is the atom mass. <em>vx</em>, <em>vy</em>, <em>vz</e
charge.</p>
<p>There are several options for outputting atom coordinates. The <em>x</em>,
<em>y</em>, <em>z</em> attributes are used to write atom coordinates &#8220;unscaled&#8221;, in
the appropriate distance <a class="reference internal" href="units.html"><span class="doc">units</span></a> (Angstroms, sigma, etc).
the appropriate distance <span class="xref doc">units</span> (Angstroms, sigma, etc).
Additionaly, you can use <em>xs</em>, <em>ys</em>, <em>zs</em> if you want to also save the
coordinates &#8220;scaled&#8221; to the box size, so that each value is 0.0 to
1.0. If the simulation box is triclinic (tilted), then all atom

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@ -364,7 +364,7 @@ bodies, as discussed below. These particles can be drawn separately
if the <em>line</em>, <em>tri</em>, or <em>body</em> keywords are used.</p>
<p>The <em>adiam</em> keyword allows you to override the <em>diameter</em> setting to
set a single numeric <em>size</em>. All atoms will be drawn with that
diameter, e.g. 1.5, which is in whatever distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>
diameter, e.g. 1.5, which is in whatever distance <span class="xref doc">units</span>
the input script defines, e.g. Angstroms.</p>
<p>The <em>bond</em> keyword allows to you to alter how bonds are drawn. A bond
is only drawn if both atoms in the bond are being drawn due to being
@ -394,7 +394,7 @@ the <a class="reference internal" href="dump_modify.html"><span class="doc">dump
<em>none</em> as indicated above).</p>
<p>If a numeric value is specified, then all bonds will be drawn as
cylinders with that diameter, e.g. 1.0, which is in whatever distance
<a class="reference internal" href="units.html"><span class="doc">units</span></a> the input script defines, e.g. Angstroms.</p>
<span class="xref doc">units</span> the input script defines, e.g. Angstroms.</p>
<p>If <em>atom</em> is specified for the <em>width</em> value, then each bond
will be drawn with a width corresponding to the minimum diameter
of the 2 atoms in the bond.</p>
@ -420,7 +420,7 @@ mapping of types to colors is as follows:</p>
change this via the <a class="reference internal" href="dump_modify.html"><span class="doc">dump_modify</span></a> command.</p>
<p>The line <em>width</em> can only be a numeric value, which specifies that all
lines will be drawn as cylinders with that diameter, e.g. 1.0, which
is in whatever distance <a class="reference internal" href="units.html"><span class="doc">units</span></a> the input script defines,
is in whatever distance <span class="xref doc">units</span> the input script defines,
e.g. Angstroms.</p>
<p>The <em>tri</em> keyword can be used when <a class="reference internal" href="atom_style.html"><span class="doc">atom_style tri</span></a> is
used to define particles as triangles, and will draw them as triangles

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@ -444,7 +444,7 @@ nanometer accuracy, e.g. for N = 1000, the coordinates are written to
<p>The <em>sfactor</em> and <em>tfactor</em> keywords only apply to the dump <em>xtc</em>
style. They allow customization of the unit conversion factors used
when writing to XTC files. By default they are initialized for
whatever <a class="reference internal" href="units.html"><span class="doc">units</span></a> style is being used, to write out
whatever <span class="xref doc">units</span> style is being used, to write out
coordinates in nanometers and time in picoseconds. I.e. for <em>real</em>
units, LAMMPS defines <em>sfactor</em> = 0.1 and <em>tfactor</em> = 0.001, since the
Angstroms and fmsec used by <em>real</em> units are 0.1 nm and 0.001 psec
@ -542,7 +542,7 @@ that atoms of each type will be drawn in the image. The specified
<em>type</em> should be an integer from 1 to Ntypes. As with the <em>acolor</em>
keyword, a wildcard asterisk can be used as part of the <em>type</em>
argument to specify a range of atomt types. The specified <em>diam</em> is
the size in whatever distance <a class="reference internal" href="units.html"><span class="doc">units</span></a> the input script is
the size in whatever distance <span class="xref doc">units</span> the input script is
using, e.g. Angstroms.</p>
<hr class="docutils" />
<p>The <em>amap</em> keyword can be used with the <a class="reference internal" href="dump_image.html"><span class="doc">dump image</span></a>
@ -687,7 +687,7 @@ set the diameter that bonds of each type will be drawn in the image.
The specified <em>type</em> should be an integer from 1 to Nbondtypes. As
with the <em>bcolor</em> keyword, a wildcard asterisk can be used as part of
the <em>type</em> argument to specify a range of bond types. The specified
<em>diam</em> is the size in whatever distance <a class="reference internal" href="units.html"><span class="doc">units</span></a> you are
<em>diam</em> is the size in whatever distance <span class="xref doc">units</span> you are
using, e.g. Angstroms.</p>
<hr class="docutils" />
<p>The <em>bitrate</em> keyword can be used with the <a class="reference internal" href="dump_image.html"><span class="doc">dump movie</span></a> command to define the size of the resulting

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@ -193,7 +193,7 @@ measured from zhi and is set with the <em>extent</em> argument.</p>
<p>The <em>units</em> keyword determines the meaning of the distance units used
to define a wall position, but only when a numeric constant is used.
A <em>box</em> value selects standard distance units as defined by the
<a class="reference internal" href="units.html"><span class="doc">units</span></a> command, e.g. Angstroms for units = real or metal.
<span class="xref doc">units</span> command, e.g. Angstroms for units = real or metal.
A <em>lattice</em> value means the distance units are in lattice spacings.
The <a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a> command must have been previously used to
define the lattice spacings.</p>

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@ -293,7 +293,7 @@ an input value from that compute.</p>
each chunk, i.e. number/volume. The <em>density/mass</em> value means the
mass density is computed for each chunk, i.e. total-mass/volume. The
output values are in units of 1/volume or density (mass/volume). See
the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command doc page for the definition of density
the <span class="xref doc">units</span> command doc page for the definition of density
for each choice of units, e.g. gram/cm^3. If the chunks defined by
the <a class="reference internal" href="compute_chunk_atom.html"><span class="doc">compute chunk/atom</span></a> command are spatial
bins, the volume is the bin volume. Otherwise it is the volume of the
@ -475,11 +475,11 @@ coordinate. For <em>bin/cylinder</em>, Coord1 and Coord2 are used. Coord1
is the radial coordinate (away from the cylinder axis), and coord2 is
the coordinate along the cylinder axis.</p>
<p>Note that if the value of the <em>units</em> keyword used in the <a class="reference internal" href="compute_chunk_atom.html"><span class="doc">compute chunk/atom command</span></a> is <em>box</em> or <em>lattice</em>, the
coordinate values will be in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>. If the
coordinate values will be in distance <span class="xref doc">units</span>. If the
value of the <em>units</em> keyword is <em>reduced</em>, the coordinate values will
be in unitless reduced units (0-1). This is not true for the Coord1 value
of style <em>bin/sphere</em> or <em>bin/cylinder</em> which both represent radial
dimensions. Those values are always in distance <a class="reference internal" href="units.html"><span class="doc">units</span></a>.</p>
dimensions. Those values are always in distance <span class="xref doc">units</span>.</p>
</div>
<hr class="docutils" />
<div class="section" id="restart-fix-modify-output-run-start-stop-minimize-info">

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@ -345,7 +345,7 @@ each bin, i.e. a weighting of 1 for each atom. The <em>density/mass</em>
value means the mass density is computed in each bind, i.e. each atom
is weighted by its mass. The resulting density is normalized by the
volume of the bin so that units of number/volume or density are
output. See the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command doc page for the
output. See the <span class="xref doc">units</span> command doc page for the
definition of density for each choice of units, e.g. gram/cm^3.</p>
<p>If a value begins with &#8220;<a href="#id1"><span class="problematic" id="id2">c_</span></a>&#8221;, a compute ID must follow which has been
previously defined in the input script. If no bracketed integer is
@ -409,7 +409,7 @@ are coordinate value. For orthogonal simulation boxes, any of the 3
options may be used. For non-orthogonal (triclinic) simulation boxes,
only the <em>reduced</em> option may be used.</p>
<p>A <em>box</em> value selects standard distance units as defined by the
<a class="reference internal" href="units.html"><span class="doc">units</span></a> command, e.g. Angstroms for units = real or metal.
<span class="xref doc">units</span> command, e.g. Angstroms for units = real or metal.
A <em>lattice</em> value means the distance units are in lattice spacings.
The <a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a> command must have been previously used to
define the lattice spacing. A <em>reduced</em> value means normalized

View File

@ -257,7 +257,7 @@ each bin, i.e. a weighting of 1 for each atom. The <em>density/mass</em>
value means the mass density is computed in each bin, i.e. each atom
is weighted by its mass. The resulting density is normalized by the
volume of the bin so that units of number/volume or density are
output. See the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command doc page for the
output. See the <span class="xref doc">units</span> command doc page for the
definition of density for each choice of units, e.g. gram/cm^3.
The bin volume will always be calculated in box units, independent
of the use of the <em>units</em> keyword in this command.</p>
@ -323,7 +323,7 @@ simulation boxes, any of the 3 options may be used. For
non-orthogonal (triclinic) simulation boxes, only the <em>reduced</em> option
may be used.</p>
<p>A <em>box</em> value selects standard distance units as defined by the
<a class="reference internal" href="units.html"><span class="doc">units</span></a> command, e.g. Angstroms for units = real or metal.
<span class="xref doc">units</span> command, e.g. Angstroms for units = real or metal.
A <em>lattice</em> value means the distance units are in lattice spacings.
The <a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a> command must have been previously used to
define the lattice spacing.</p>

View File

@ -266,7 +266,7 @@ after 10 psec, the box length will have doubled. After 20 psec, it
will have tripled.</p>
<p>The <em>erate</em> style changes a dimension of the the box at a &#8220;constant
engineering strain rate&#8221;. The units of the specified strain rate are
1/time. See the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command for the time units
1/time. See the <span class="xref doc">units</span> command for the time units
associated with different choices of simulation units,
e.g. picoseconds for &#8220;metal&#8221; units). Tensile strain is unitless and
is defined as delta/L0, where L0 is the original box length and delta
@ -289,7 +289,7 @@ strain rate&#8221;. Note that this is not an &#8220;engineering strain rate&#82
the other styles are. Rather, for a &#8220;true&#8221; rate, the rate of change
is constant, which means the box dimension changes non-linearly with
time from its initial to final value. The units of the specified
strain rate are 1/time. See the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command for the
strain rate are 1/time. See the <span class="xref doc">units</span> command for the
time units associated with different choices of simulation units,
e.g. picoseconds for &#8220;metal&#8221; units). Tensile strain is unitless and
is defined as delta/L0, where L0 is the original box length and delta
@ -405,7 +405,7 @@ tilt factor will be 15 Angstroms. After 2 psec, it will be 25
Angstroms.</p>
<p>The <em>erate</em> style changes a tilt factor at a &#8220;constant engineering
shear strain rate&#8221;. The units of the specified shear strain rate are
1/time. See the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command for the time units
1/time. See the <span class="xref doc">units</span> command for the time units
associated with different choices of simulation units,
e.g. picoseconds for &#8220;metal&#8221; units). Shear strain is unitless and is
defined as offset/length, where length is the box length perpendicular
@ -433,7 +433,7 @@ rate&#8221;, as the other styles are. Rather, for a &#8220;true&#8221; rate, th
of change is constant, which means the tilt factor changes
non-linearly with time from its initial to final value. The units of
the specified shear strain rate are 1/time. See the
<a class="reference internal" href="units.html"><span class="doc">units</span></a> command for the time units associated with
<span class="xref doc">units</span> command for the time units associated with
different choices of simulation units, e.g. picoseconds for &#8220;metal&#8221;
units). Shear strain is unitless and is defined as offset/length,
where length is the box length perpendicular to the shear direction
@ -608,7 +608,7 @@ irregular-shaped sub-domain. For extreme values of tilt, LAMMPS may
also lose atoms and generate an error.</p>
<p>The <em>units</em> keyword determines the meaning of the distance units used
to define various arguments. A <em>box</em> value selects standard distance
units as defined by the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command, e.g. Angstroms for
units as defined by the <span class="xref doc">units</span> command, e.g. Angstroms for
units = real or metal. A <em>lattice</em> value means the distance units are
in lattice spacings. The <a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a> command must have
been previously used to define the lattice spacing. Note that the

View File

@ -334,7 +334,7 @@ particles will be consecutive even if particles leave the system over
time.</p>
<p>The <em>units</em> keyword determines the meaning of the distance units used
for the other deposition parameters. A <em>box</em> value selects standard
distance units as defined by the <a class="reference internal" href="units.html"><span class="doc">units</span></a> command,
distance units as defined by the <span class="xref doc">units</span> command,
e.g. Angstroms for units = real or metal. A <em>lattice</em> value means the
distance units are in lattice spacings. The <a class="reference internal" href="lattice.html"><span class="doc">lattice</span></a>
command must have been previously used to define the lattice spacing.

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