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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12618 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp 2014-10-07 22:56:39 +00:00
parent 9ad09005a6
commit f346f90c4e
6 changed files with 10 additions and 6 deletions
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2
doc/fix.html
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@ -233,7 +233,7 @@ in the fix section of <A HREF = "Section_commands.html#cmd_5">this page</A>.
<LI><A HREF = "fix_press_berendsen.html">press/berendsen</A> - pressure control by Berendsen barostat
<LI><A HREF = "fix_print.html">print</A> - print text and variables during a simulation
<LI><A HREF = "fix_property_atom.html">property/atom</A> - add customized per-atom values
<LI><A HREF = "fix_qeq/comb.html">qeq/comb</A> - charge equilibration for COMB potential <A HREF = "fix_reax_bonds.html">reax/bonds</A> - write out ReaxFF bond information <A HREF = "fix_recenter.html">recenter</A> - constrain the center-of-mass position of a group of atoms
<LI><A HREF = "fix_qeq_comb.html">qeq/comb</A> - charge equilibration for COMB potential <A HREF = "fix_qeq.html">qeq/dynamic</A> - charge equilibration via dynamic method <A HREF = "fix_qeq.html">qeq/point</A> - charge equilibration via point method <A HREF = "fix_qeq.html">qeq/shielded</A> - charge equilibration via shielded method <A HREF = "fix_qeq.html">qeq/slater</A> - charge equilibration via Slater method <A HREF = "fix_reax_bonds.html">reax/bonds</A> - write out ReaxFF bond information <A HREF = "fix_recenter.html">recenter</A> - constrain the center-of-mass position of a group of atoms
<LI><A HREF = "fix_restrain.html">restrain</A> - constrain a bond, angle, dihedral
<LI><A HREF = "fix_rigid.html">rigid</A> - constrain one or more clusters of atoms to move as a rigid body with NVE integration
<LI><A HREF = "fix_rigid.html">rigid/nph</A> - constrain one or more clusters of atoms to move as a rigid body with NPH integration

6
doc/fix.txt
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@ -230,7 +230,11 @@ in the fix section of "this page"_Section_commands.html#cmd_5.
Berendsen barostat
"print"_fix_print.html - print text and variables during a simulation
"property/atom"_fix_property_atom.html - add customized per-atom values
"qeq/comb"_fix_qeq/comb.html - charge equilibration for COMB potential \
"qeq/comb"_fix_qeq_comb.html - charge equilibration for COMB potential \
"qeq/dynamic"_fix_qeq.html - charge equilibration via dynamic method \
"qeq/point"_fix_qeq.html - charge equilibration via point method \
"qeq/shielded"_fix_qeq.html - charge equilibration via shielded method \
"qeq/slater"_fix_qeq.html - charge equilibration via Slater method \
"reax/bonds"_fix_reax_bonds.html - write out ReaxFF bond information \
"recenter"_fix_recenter.html - constrain the center-of-mass position \
of a group of atoms

2
doc/fix_qeq.html
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@ -185,7 +185,7 @@ LAMMPS</A> section for more info.
<A NAME = "Rappe"></A>
<P><B>(Rappe and Goddard)</B> A. K. Rappe and W. A. Goddard III, J Physical
Chemistry, 105, 3358-3363 (1991).
Chemistry, 95, 3358-3363 (1991).
</P>
<A NAME = "Nakano"></A>

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doc/fix_qeq.txt
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@ -178,7 +178,7 @@ LAMMPS"_Section_start.html#start_3 section for more info.
:link(Rappe)
[(Rappe and Goddard)] A. K. Rappe and W. A. Goddard III, J Physical
Chemistry, 105, 3358-3363 (1991).
Chemistry, 95, 3358-3363 (1991).
:link(Nakano)
[(Nakano)] A. Nakano, Computer Physics Communications, 104, 59-69 (1997).

2
doc/fix_qeq_reax.html
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@ -91,7 +91,7 @@ be used for periodic cell dimensions less than 10 angstroms.
<A NAME = "Rappe"></A>
<P><B>(Rappe)</B> Rappe and Goddard III, Journal of Physical Chemistry, 105,
<P> <B>(Rappe)</B> Rappe and Goddard III, Journal of Physical Chemistry, 95,
3358-3363 (1991).
</P>
<A NAME = "Nakano"></A>

2
doc/fix_qeq_reax.txt
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@ -87,7 +87,7 @@ be used for periodic cell dimensions less than 10 angstroms.
:line
:link(Rappe)
[(Rappe)] Rappe and Goddard III, Journal of Physical Chemistry, 105,
[(Rappe)] Rappe and Goddard III, Journal of Physical Chemistry, 95,
3358-3363 (1991).
:link(Nakano)