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multiscale
lammps
Commits
0eb7fbf3
Commit
0eb7fbf3
authored
8 years ago
by
Steve Plimpton
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tweaks to new USER-DPD docs
parent
fbf7df14
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doc/src/Section_commands.txt
+2
-0
2 additions, 0 deletions
doc/src/Section_commands.txt
doc/src/fix_dpd_energy.txt
+5
-5
5 additions, 5 deletions
doc/src/fix_dpd_energy.txt
with
7 additions
and
5 deletions
doc/src/Section_commands.txt
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2
−
0
View file @
0eb7fbf3
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@@ -618,6 +618,7 @@ package"_Section_start.html#start_3.
...
@@ -618,6 +618,7 @@ package"_Section_start.html#start_3.
"atc"_fix_atc.html,
"atc"_fix_atc.html,
"ave/correlate/long"_fix_ave_correlate_long.html,
"ave/correlate/long"_fix_ave_correlate_long.html,
"colvars"_fix_colvars.html,
"colvars"_fix_colvars.html,
"dpd/energy"_fix_dpd_energy.html,
"drude"_fix_drude.html,
"drude"_fix_drude.html,
"drude/transform/direct"_fix_drude_transform.html,
"drude/transform/direct"_fix_drude_transform.html,
"drude/transform/reverse"_fix_drude_transform.html,
"drude/transform/reverse"_fix_drude_transform.html,
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@@ -923,6 +924,7 @@ KOKKOS, o = USER-OMP, t = OPT.
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@@ -923,6 +924,7 @@ KOKKOS, o = USER-OMP, t = OPT.
"tip4p/long (o)"_pair_coul.html,
"tip4p/long (o)"_pair_coul.html,
"tri/lj"_pair_tri_lj.html,
"tri/lj"_pair_tri_lj.html,
"vashishta (o)"_pair_vashishta.html,
"vashishta (o)"_pair_vashishta.html,
"vashishta/table (o)"_pair_vashishta_table.html,
"yukawa (go)"_pair_yukawa.html,
"yukawa (go)"_pair_yukawa.html,
"yukawa/colloid (go)"_pair_yukawa_colloid.html,
"yukawa/colloid (go)"_pair_yukawa_colloid.html,
"zbl (go)"_pair_zbl.html :tb(c=4,ea=c)
"zbl (go)"_pair_zbl.html :tb(c=4,ea=c)
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doc/src/fix_dpd_energy.txt
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0eb7fbf3
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@@ -21,10 +21,10 @@ fix 1 all dpd/energy :pre
...
@@ -21,10 +21,10 @@ fix 1 all dpd/energy :pre
[Description:]
[Description:]
Perform constant energy dissipative particle dynamics (DPD-E)
integration.
Perform constant energy dissipative particle dynamics (DPD-E)
The fix {dpd/energy}
updates the internal energies for particles in
the group
integration. This fix
updates the internal energies for particles in
at each timestep.
The fix {dpd/energy}
must be used in conjunction with a
the group
at each timestep.
It
must be used in conjunction with a
deterministic integrator (e.g. "fix nve"_fix_nve.html) that updates
deterministic integrator (e.g. "fix nve"_fix_nve.html) that updates
the particle positions and velocities.
the particle positions and velocities.
For fix {dpd/energy}, the particle internal temperature is related to
For fix {dpd/energy}, the particle internal temperature is related to
...
@@ -32,7 +32,7 @@ the particle internal energy through a mesoparticle equation of state.
...
@@ -32,7 +32,7 @@ the particle internal energy through a mesoparticle equation of state.
An additional fix must be specified that defines the equation of state
An additional fix must be specified that defines the equation of state
for each particle, e.g. "fix eos/cv"_fix_eos_cv.html.
for each particle, e.g. "fix eos/cv"_fix_eos_cv.html.
Th
e
fix
{dpd/energy}
must be used with the "pair_style
Th
is
fix must be used with the "pair_style
dpd/fdt/energy"_pair_style.html command.
dpd/fdt/energy"_pair_style.html command.
Note that numerous variants of DPD can be specified by choosing an
Note that numerous variants of DPD can be specified by choosing an
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