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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@170 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2006-11-28 17:00:29 +00:00
parent ca3dfbd217
commit 00ed5ab33f
6 changed files with 16 additions and 8 deletions
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4
doc/Section_commands.html
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@ -326,8 +326,8 @@ description:
<TR ALIGN="center"><TD ><A HREF = "pair_style_charmm.html">lj/charmm/coul/charmm</A></TD><TD ><A HREF = "pair_style_charmm.html">lj/charmm/coul/charmm/implicit</A></TD><TD ><A HREF = "pair_style_charmm.html">lj/charmm/coul/long</A></TD><TD ><A HREF = "pair_style_class2.html">lj/class2</A></TD></TR> <TR ALIGN="center"><TD ><A HREF = "pair_style_charmm.html">lj/charmm/coul/charmm</A></TD><TD ><A HREF = "pair_style_charmm.html">lj/charmm/coul/charmm/implicit</A></TD><TD ><A HREF = "pair_style_charmm.html">lj/charmm/coul/long</A></TD><TD ><A HREF = "pair_style_class2.html">lj/class2</A></TD></TR>
<TR ALIGN="center"><TD ><A HREF = "pair_style_class2.html">lj/class2/coul/cut</A></TD><TD ><A HREF = "pair_style_class2.html">lj/class2/coul/long</A></TD><TD ><A HREF = "pair_style_lj.html">lj/cut</A></TD><TD ><A HREF = "pair_style_lj.html">lj/cut/coul/cut</A></TD></TR> <TR ALIGN="center"><TD ><A HREF = "pair_style_class2.html">lj/class2/coul/cut</A></TD><TD ><A HREF = "pair_style_class2.html">lj/class2/coul/long</A></TD><TD ><A HREF = "pair_style_lj.html">lj/cut</A></TD><TD ><A HREF = "pair_style_lj.html">lj/cut/coul/cut</A></TD></TR>
<TR ALIGN="center"><TD ><A HREF = "pair_style_lj.html">lj/cut/coul/debye</A></TD><TD ><A HREF = "pair_style_lj.html">lj/cut/coul/long</A></TD><TD ><A HREF = "pair_style_lj.html">lj/cut/coul/long/tip4p</A></TD><TD ><A HREF = "pair_style_lj_expand.html">lj/expand</A></TD></TR> <TR ALIGN="center"><TD ><A HREF = "pair_style_lj.html">lj/cut/coul/debye</A></TD><TD ><A HREF = "pair_style_lj.html">lj/cut/coul/long</A></TD><TD ><A HREF = "pair_style_lj.html">lj/cut/coul/long/tip4p</A></TD><TD ><A HREF = "pair_style_lj_expand.html">lj/expand</A></TD></TR>
<TR ALIGN="center"><TD ><A HREF = "pair_style_lj_smooth.html">lj/smooth</A></TD><TD ><A HREF = "pair_style_morse.html">morse</A></TD><TD ><A HREF = "pair_style_soft.html">soft</A></TD><TD ><A HREF = "pair_style_table.html">table</A></TD></TR> <TR ALIGN="center"><TD ><A HREF = "pair_style_lj_smooth.html">lj/smooth</A></TD><TD ><A HREF = "pair_style_morse.html">morse</A></TD><TD ><A HREF = "pair_style_soft.html">soft</A></TD><TD ><A HREF = "pair_style_sw.html">sw</A></TD></TR>
<TR ALIGN="center"><TD ><A HREF = "pair_style_yukawa.html">yukawa</A> <TR ALIGN="center"><TD ><A HREF = "pair_style_table.html">table</A></TD><TD ><A HREF = "pair_style_tersoff.html">tersoff</A></TD><TD ><A HREF = "pair_style_yukawa.html">yukawa</A>
</TD></TR></TABLE></DIV> </TD></TR></TABLE></DIV>
<P>Bond styles. See the <A HREF = "bond_style.html">bond_style</A> command for an <P>Bond styles. See the <A HREF = "bond_style.html">bond_style</A> command for an

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doc/Section_commands.txt
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@ -434,7 +434,9 @@ description:
"lj/smooth"_pair_style_lj_smooth.html, "lj/smooth"_pair_style_lj_smooth.html,
"morse"_pair_style_morse.html, "morse"_pair_style_morse.html,
"soft"_pair_style_soft.html, "soft"_pair_style_soft.html,
"sw"_pair_style_sw.html,
"table"_pair_style_table.html, "table"_pair_style_table.html,
"tersoff"_pair_style_tersoff.html,
"yukawa"_pair_style_yukawa.html :tb(c=4,ea=c) "yukawa"_pair_style_yukawa.html :tb(c=4,ea=c)
Bond styles. See the "bond_style"_bond_style.html command for an Bond styles. See the "bond_style"_bond_style.html command for an

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doc/pair_style.html
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@ -31,7 +31,9 @@
<LI><I>lj/smooth</I> <LI><I>lj/smooth</I>
<LI><I>morse</I> <LI><I>morse</I>
<LI><I>soft</I> <LI><I>soft</I>
<LI><I>sw</I>
<LI><I>table</I> <LI><I>table</I>
<LI><I>tersoff</I>
<LI><I>yukawa</I> <LI><I>yukawa</I>
</UL> </UL>
<LI>args = arguments used by a particular style <LI>args = arguments used by a particular style
@ -56,8 +58,9 @@ remain in place for the duration of a simulation.
<P>In LAMMPS, pairwise force fields encompass a variety of interactions, <P>In LAMMPS, pairwise force fields encompass a variety of interactions,
some of which include many-body effects, e.g. EAM, Stillinger-Weber, some of which include many-body effects, e.g. EAM, Stillinger-Weber,
Tersoff, REBO potentials. They are still classed as "pairwise" Tersoff, REBO potentials. They are still classed as "pairwise"
potential because a neighbor list is used to find nearby interacting potential because the set of interacting atoms changes with time
atoms. (unlike a bonded system) and thus a neighbor list is used to find
nearby interacting atoms.
</P> </P>
<P>Hybrid models where specified pairs of atom types interact via <P>Hybrid models where specified pairs of atom types interact via
different pair potentials can be setup using the <I>hybrid</I> pair style. different pair potentials can be setup using the <I>hybrid</I> pair style.

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doc/pair_style.txt
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@ -28,7 +28,9 @@ style = one of the following :ulb,l
{lj/smooth} {lj/smooth}
{morse} {morse}
{soft} {soft}
{sw}
{table} {table}
{tersoff}
{yukawa} :ul {yukawa} :ul
args = arguments used by a particular style :l,ule args = arguments used by a particular style :l,ule
@ -53,8 +55,9 @@ remain in place for the duration of a simulation.
In LAMMPS, pairwise force fields encompass a variety of interactions, In LAMMPS, pairwise force fields encompass a variety of interactions,
some of which include many-body effects, e.g. EAM, Stillinger-Weber, some of which include many-body effects, e.g. EAM, Stillinger-Weber,
Tersoff, REBO potentials. They are still classed as "pairwise" Tersoff, REBO potentials. They are still classed as "pairwise"
potential because a neighbor list is used to find nearby interacting potential because the set of interacting atoms changes with time
atoms. (unlike a bonded system) and thus a neighbor list is used to find
nearby interacting atoms.
Hybrid models where specified pairs of atom types interact via Hybrid models where specified pairs of atom types interact via
different pair potentials can be setup using the {hybrid} pair style. different pair potentials can be setup using the {hybrid} pair style.

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doc/pair_style_tersoff.html
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@ -69,7 +69,7 @@ above:
<LI>lambda3 (1/distance units) <LI>lambda3 (1/distance units)
<LI>c <LI>c
<LI>d <LI>d
<LI>costheta0 <LI>costheta0 (can be a value < -1 or > 1)
<LI>n <LI>n
<LI>beta <LI>beta
<LI>lambda2 (1/distance units) <LI>lambda2 (1/distance units)

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doc/pair_style_tersoff.txt
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@ -66,7 +66,7 @@ element 3
lambda3 (1/distance units) lambda3 (1/distance units)
c c
d d
costheta0 costheta0 (can be a value < -1 or > 1)
n n
beta beta
lambda2 (1/distance units) lambda2 (1/distance units)