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sjplimp
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<HTML>
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<CENTER><A HREF = "http://lammps.sandia.gov">LAMMPS WWW Site</A> - <A HREF = "Manual.html">LAMMPS Documentation</A> - <A HREF = "Section_commands.html#comm">LAMMPS Commands</A>
|
||||
</CENTER>
|
||||
|
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||||
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||||
|
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<HR>
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<H3>angle_style cg/cmm command
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</H3>
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<P><B>Syntax:</B>
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</P>
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<PRE>angle_style cg/cmm
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</PRE>
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<P><B>Examples:</B>
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</P>
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<PRE>angle_style cg/cmm
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angle_coeff 1 300.0 107.0 lj9_6 0.4491 3.7130
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</PRE>
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<P><B>Description:</B>
|
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</P>
|
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<P>The <I>cg/cmm</I> angle style is a combination of the harmonic angle potential,
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</P>
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<CENTER><IMG SRC = "Eqs/angle_harmonic.jpg">
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</CENTER>
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<P>where theta0 is the equilibrium value of the angle and K a prefactor,
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with the <I>repulsive</I> part of the non-bonded <I>cg/cmm</I> pair style
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between the atoms 1 and 3. This angle potential is intended for
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coarse grained MD simulations with the CMM parametrization using the
|
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<A HREF = "pair_cmm.html">pair_style cg/cmm</A>. Relative to the pair_style
|
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<I>cg/cmm</I>, however, the energy is shifted by <I>epsilon</I>, to avoid sudden
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jumps. Note that the usual 1/2 factor is included in K.
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</P>
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<P>The following coefficients must be defined for each angle type via the
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<A HREF = "angle_coeff.html">angle_coeff</A> command as in the example above. As
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with other CMM coarse grained parameters, they cannot be set in the
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data file, but can be restored from restarts via the
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<A HREF = "read_restart.html">read_restart</A> command:
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</P>
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<UL><LI>K (energy/radian^2)
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<LI>theta0 (degrees)
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<LI>cg_type (string, one of lj9_6, lj12_4, lj12_6)
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<LI>epsilon (energy units)
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<LI>sigma (distance units)
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</UL>
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<P>Theta0 is specified in degrees, but LAMMPS converts it to radians
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internally; hence the units of K are in energy/radian^2.
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</P>
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<P><B>Restrictions:</B>
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</P>
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<P>This angle style can only be used if LAMMPS was built with the
|
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USER-CG-CMM package. See the <A HREF = "Section_start.html#start_3">Making
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LAMMPS</A> section for more info on packages.
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</P>
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<P><B>Related commands:</B>
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</P>
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<P><A HREF = "angle_coeff.html">angle_coeff</A>, <A HREF = "angle_harmonic.html">angle_style
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harmonic</A>, <A HREF = "pair_cmm.html">pair_style cg/cmm</A>
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</P>
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<P><B>Default:</B> none
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</P>
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</HTML>
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@ -1,60 +0,0 @@
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"LAMMPS WWW Site"_lws - "LAMMPS Documentation"_ld - "LAMMPS Commands"_lc :c
|
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|
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:link(lws,http://lammps.sandia.gov)
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:link(ld,Manual.html)
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:link(lc,Section_commands.html#comm)
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:line
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angle_style cg/cmm command :h3
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[Syntax:]
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angle_style cg/cmm :pre
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[Examples:]
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angle_style cg/cmm
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angle_coeff 1 300.0 107.0 lj9_6 0.4491 3.7130 :pre
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[Description:]
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The {cg/cmm} angle style is a combination of the harmonic angle potential,
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|
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:c,image(Eqs/angle_harmonic.jpg)
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|
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where theta0 is the equilibrium value of the angle and K a prefactor,
|
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with the {repulsive} part of the non-bonded {cg/cmm} pair style
|
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between the atoms 1 and 3. This angle potential is intended for
|
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coarse grained MD simulations with the CMM parametrization using the
|
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"pair_style cg/cmm"_pair_cmm.html. Relative to the pair_style
|
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{cg/cmm}, however, the energy is shifted by {epsilon}, to avoid sudden
|
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jumps. Note that the usual 1/2 factor is included in K.
|
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|
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The following coefficients must be defined for each angle type via the
|
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"angle_coeff"_angle_coeff.html command as in the example above. As
|
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with other CMM coarse grained parameters, they cannot be set in the
|
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data file, but can be restored from restarts via the
|
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"read_restart"_read_restart.html command:
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|
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K (energy/radian^2)
|
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theta0 (degrees)
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cg_type (string, one of lj9_6, lj12_4, lj12_6)
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epsilon (energy units)
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sigma (distance units) :ul
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|
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Theta0 is specified in degrees, but LAMMPS converts it to radians
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internally; hence the units of K are in energy/radian^2.
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[Restrictions:]
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|
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This angle style can only be used if LAMMPS was built with the
|
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USER-CG-CMM package. See the "Making
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LAMMPS"_Section_start.html#start_3 section for more info on packages.
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||||
|
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[Related commands:]
|
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|
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"angle_coeff"_angle_coeff.html, "angle_style
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harmonic"_angle_harmonic.html, "pair_style cg/cmm"_pair_cmm.html
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[Default:] none
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@ -1,203 +0,0 @@
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<HTML>
|
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<CENTER><A HREF = "http://lammps.sandia.gov">LAMMPS WWW Site</A> - <A HREF = "Manual.html">LAMMPS Documentation</A> - <A HREF = "Section_commands.html#comm">LAMMPS Commands</A>
|
||||
</CENTER>
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|
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|
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<HR>
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<H3>pair_style cg/cmm command
|
||||
</H3>
|
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<H3>pair_style cg/cmm/cuda command
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</H3>
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<H3>pair_style cg/cmm/gpu command
|
||||
</H3>
|
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<H3>pair_style cg/cmm/coul/cut command
|
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</H3>
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<H3>pair_style cg/cmm/coul/cut/cuda command
|
||||
</H3>
|
||||
<H3>pair_style cg/cmm/coul/debye/cuda command
|
||||
</H3>
|
||||
<H3>pair_style cg/cmm/coul/long command
|
||||
</H3>
|
||||
<H3>pair_style cg/cmm/coul/long/gpu command
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||||
</H3>
|
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<H3>pair_style cg/cmm/coul/long/cuda command
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</H3>
|
||||
<P><B>Syntax:</B>
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</P>
|
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<PRE>pair_style style args
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</PRE>
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<UL><LI>style = <I>cg/cmm</I> or <I>cg/cmm/coul/cut</I> or <I>cg/cmm/coul/long</I>
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<LI>args = list of arguments for a particular style
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</UL>
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<PRE> <I>cg/cmm</I> args = cutoff
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cutoff = global cutoff for Lennard Jones interactions (distance units)
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<I>cg/cmm/coul/cut</I> args = cutoff (cutoff2) (kappa)
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cutoff = global cutoff for LJ (and Coulombic if only 1 arg) (distance units)
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cutoff2 = global cutoff for Coulombic (optional) (distance units)
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kappa = Debye length (optional, defaults to 0.0 = disabled) (inverse distance units)
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<I>cg/cmm/coul/long</I> args = cutoff (cutoff2)
|
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cutoff = global cutoff for LJ (and Coulombic if only 1 arg) (distance units)
|
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cutoff2 = global cutoff for Coulombic (optional) (distance units)
|
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</PRE>
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<P><B>Examples:</B>
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</P>
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<PRE>pair_style cg/cmm 2.5
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pair_coeff 1 1 lj12_6 1 1.1 2.8
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</PRE>
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<PRE>pair_style cg/cmm/coul/cut 10.0 12.0
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pair_coeff 1 1 lj9_6 100.0 3.5 9.0
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pair_coeff 1 1 lj12_4 100.0 3.5 9.0 9.0
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</PRE>
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<PRE>pair_style cg/cmm/coul/long 10.0
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pair_style cg/cmm/coul/long 10.0 8.0
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pair_coeff 1 1 lj9_6 100.0 3.5 9.0
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</PRE>
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<P><B>Description:</B>
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</P>
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<P>The <I>cg/cmm</I> styles compute a 9/6, 12/4, or 12/6 Lennard-Jones potential,
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given by
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</P>
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<CENTER><IMG SRC = "Eqs/pair_cmm.jpg">
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</CENTER>
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<P>as required for the CMM Coarse-grained MD parametrization discussed in
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<A HREF = "#Shinoda">(Shinoda)</A> and <A HREF = "#DeVane">(DeVane)</A>. Rc is the cutoff.
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</P>
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<P>Style <I>cg/cmm/coul/cut</I> adds a Coulombic pairwise interaction given by
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</P>
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<CENTER><IMG SRC = "Eqs/pair_coulomb.jpg">
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</CENTER>
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<P>where C is an energy-conversion constant, Qi and Qj are the charges on
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the 2 atoms, and epsilon is the dielectric constant which can be set
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by the <A HREF = "dielectric.html">dielectric</A> command. If one cutoff is
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specified in the pair_style command, it is used for both the LJ and
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Coulombic terms. If two cutoffs are specified, they are used as
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cutoffs for the LJ and Coulombic terms respectively.
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</P>
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<P>This style also contains an additional exp() damping factor
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to the Coulombic term, given by
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</P>
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<CENTER><IMG SRC = "Eqs/pair_debye.jpg">
|
||||
</CENTER>
|
||||
<P>where kappa is the Debye length (kappa=0.0 is the unscreened coulomb).
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This potential is another way to mimic the screening effect of a polar
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solvent.
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||||
</P>
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||||
<P>Style <I>cg/cmm/coul/long</I> computes the same Coulombic interactions as
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||||
style <I>cg/cmm/coul/cut</I> except that an additional damping factor is
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applied to the Coulombic term so it can be used in conjunction with
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the <A HREF = "kspace_style.html">kspace_style</A> command and its <I>ewald</I> or <I>pppm</I>
|
||||
option. The Coulombic cutoff specified for this style means that
|
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pairwise interactions within this distance are computed directly;
|
||||
interactions outside that distance are computed in reciprocal space.
|
||||
</P>
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||||
<P>The following coefficients must be defined for each pair of atoms
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types via the <A HREF = "pair_coeff.html">pair_coeff</A> command as in the examples
|
||||
above, or in the data file or restart files read by the
|
||||
<A HREF = "read_data.html">read_data</A> or <A HREF = "read_restart.html">read_restart</A>
|
||||
commands, or by mixing as described below:
|
||||
</P>
|
||||
<UL><LI>cg_type (lj9_6, lj12_4, or lj12_6)
|
||||
<LI>epsilon (energy units)
|
||||
<LI>sigma (distance units)
|
||||
<LI>cutoff1 (distance units)
|
||||
<LI>cutoff2 (distance units)
|
||||
</UL>
|
||||
<P>Note that sigma is defined in the LJ formula as the zero-crossing
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distance for the potential, not as the energy minimum. The prefactors
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||||
are chosen so that the potential minimum is at -epsilon.
|
||||
</P>
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<P>The latter 2 coefficients are optional. If not specified, the global
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LJ and Coulombic cutoffs specified in the pair_style command are used.
|
||||
If only one cutoff is specified, it is used as the cutoff for both LJ
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||||
and Coulombic interactions for this type pair. If both coefficients
|
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are specified, they are used as the LJ and Coulombic cutoffs for this
|
||||
type pair.
|
||||
</P>
|
||||
<P>For <I>cg/cmm/coul/long</I> only the LJ cutoff can be specified since a
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||||
Coulombic cutoff cannot be specified for an individual I,J type pair.
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All type pairs use the same global Coulombic cutoff specified in the
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pair_style command.
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</P>
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||||
<HR>
|
||||
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||||
<P>Styles with a <I>cuda</I>, <I>gpu</I>, or <I>opt</I> suffix are functionally the same
|
||||
as the corresponding style without the suffix. They have been
|
||||
optimized to run faster, depending on your available hardware, as
|
||||
discussed in <A HREF = "Section_accelerate.html">this section</A> of the manual.
|
||||
The accelerated styles take the same arguments and should produce the
|
||||
same results, except for round-off and precision issues.
|
||||
</P>
|
||||
<P>These accelerated styles are part of the USER-CUDA, GPU, and OPT
|
||||
packages respectively. They are only enabled if LAMMPS was built with
|
||||
those packages. See the <A HREF = "Section_start.html#start_3">Making LAMMPS</A>
|
||||
section for more info.
|
||||
</P>
|
||||
<P>You can specify the accelerated styles explicitly in your input script
|
||||
by including their suffix, or you can use the <A HREF = "Section_start.html#start_6">-suffix command-line
|
||||
switch</A> when you invoke LAMMPS, or you can
|
||||
use the <A HREF = "suffix.html">suffix</A> command in your input script.
|
||||
</P>
|
||||
<P>See <A HREF = "Section_accelerate.html">this section</A> of the manual for more
|
||||
instructions on how to use the accelerated styles effectively.
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<P><B>Mixing, shift, table, tail correction, restart, and rRESPA info</B>:
|
||||
</P>
|
||||
<P>For atom type pairs I,J and I != J, the epsilon and sigma coefficients
|
||||
and cutoff distance for all of the cg/cmm pair styles <I>cannot</I> be mixed,
|
||||
since different pairs may have different exponents. So all parameters
|
||||
for all pairs have to be specified explicitly through the "pair_coeff"
|
||||
command. Defining then in a data file is also not supported, due to
|
||||
limitations of that file format.
|
||||
</P>
|
||||
<P>All of the cg/cmm pair styles support the
|
||||
<A HREF = "pair_modify.html">pair_modify</A> shift option for the energy of the
|
||||
Lennard-Jones portion of the pair interaction.
|
||||
</P>
|
||||
<P>The <I>cg/cmm/coul/long</I> pair styles support the
|
||||
<A HREF = "pair_modify.html">pair_modify</A> table option since they can tabulate
|
||||
the short-range portion of the long-range Coulombic interaction.
|
||||
</P>
|
||||
<P>All of the cg/cmm pair styles write their information to <A HREF = "restart.html">binary
|
||||
restart files</A>, so pair_style and pair_coeff commands do
|
||||
not need to be specified in an input script that reads a restart file.
|
||||
</P>
|
||||
<P>The cg/cmm, cg/cmm/coul/cut and lj/cut/coul/long pair styles support
|
||||
the use of the <I>inner</I>, <I>middle</I>, and <I>outer</I> keywords of the <A HREF = "run_style.html">run_style
|
||||
respa</A> command, meaning the pairwise forces can be
|
||||
partitioned by distance at different levels of the rRESPA hierarchy.
|
||||
See the <A HREF = "run_style.html">run_style</A> command for details.
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<P><B>Restrictions:</B>
|
||||
</P>
|
||||
<P>All of the cg/cmm pair styles are part of the USER-CG-CMM package.
|
||||
The <I>cg/cmm/coul/long</I> style also requires the KSPACE package to be
|
||||
built (which is enabled by default). They are only enabled if LAMMPS
|
||||
was built with that package. See the <A HREF = "Section_start.html#start_3">Making
|
||||
LAMMPS</A> section for more info.
|
||||
</P>
|
||||
<P><B>Related commands:</B>
|
||||
</P>
|
||||
<P><A HREF = "pair_coeff.html">pair_coeff</A>, <A HREF = "angle_cmm.html">angle_style cg/cmm</A>
|
||||
</P>
|
||||
<P><B>Default:</B> none
|
||||
</P>
|
||||
<HR>
|
||||
|
||||
<A NAME = "Shinoda"></A>
|
||||
|
||||
<P><B>(Shinoda)</B> Shinoda, DeVane, Klein, Mol Sim, 33, 27 (2007).
|
||||
</P>
|
||||
<A NAME = "DeVane"></A>
|
||||
|
||||
<P><B>(DeVane)</B> Shinoda, DeVane, Klein, Soft Matter, 4, 2453-2462 (2008).
|
||||
</P>
|
||||
</HTML>
|
||||
188
doc/pair_cmm.txt
188
doc/pair_cmm.txt
|
|
@ -1,188 +0,0 @@
|
|||
"LAMMPS WWW Site"_lws - "LAMMPS Documentation"_ld - "LAMMPS Commands"_lc :c
|
||||
|
||||
:link(lws,http://lammps.sandia.gov)
|
||||
:link(ld,Manual.html)
|
||||
:link(lc,Section_commands.html#comm)
|
||||
|
||||
:line
|
||||
|
||||
pair_style cg/cmm command :h3
|
||||
pair_style cg/cmm/cuda command :h3
|
||||
pair_style cg/cmm/gpu command :h3
|
||||
pair_style cg/cmm/coul/cut command :h3
|
||||
pair_style cg/cmm/coul/cut/cuda command :h3
|
||||
pair_style cg/cmm/coul/debye/cuda command :h3
|
||||
pair_style cg/cmm/coul/long command :h3
|
||||
pair_style cg/cmm/coul/long/gpu command :h3
|
||||
pair_style cg/cmm/coul/long/cuda command :h3
|
||||
|
||||
[Syntax:]
|
||||
|
||||
pair_style style args :pre
|
||||
|
||||
style = {cg/cmm} or {cg/cmm/coul/cut} or {cg/cmm/coul/long}
|
||||
args = list of arguments for a particular style :ul
|
||||
{cg/cmm} args = cutoff
|
||||
cutoff = global cutoff for Lennard Jones interactions (distance units)
|
||||
{cg/cmm/coul/cut} args = cutoff (cutoff2) (kappa)
|
||||
cutoff = global cutoff for LJ (and Coulombic if only 1 arg) (distance units)
|
||||
cutoff2 = global cutoff for Coulombic (optional) (distance units)
|
||||
kappa = Debye length (optional, defaults to 0.0 = disabled) (inverse distance units)
|
||||
{cg/cmm/coul/long} args = cutoff (cutoff2)
|
||||
cutoff = global cutoff for LJ (and Coulombic if only 1 arg) (distance units)
|
||||
cutoff2 = global cutoff for Coulombic (optional) (distance units) :pre
|
||||
|
||||
[Examples:]
|
||||
|
||||
pair_style cg/cmm 2.5
|
||||
pair_coeff 1 1 lj12_6 1 1.1 2.8 :pre
|
||||
|
||||
pair_style cg/cmm/coul/cut 10.0 12.0
|
||||
pair_coeff 1 1 lj9_6 100.0 3.5 9.0
|
||||
pair_coeff 1 1 lj12_4 100.0 3.5 9.0 9.0 :pre
|
||||
|
||||
pair_style cg/cmm/coul/long 10.0
|
||||
pair_style cg/cmm/coul/long 10.0 8.0
|
||||
pair_coeff 1 1 lj9_6 100.0 3.5 9.0 :pre
|
||||
|
||||
[Description:]
|
||||
|
||||
The {cg/cmm} styles compute a 9/6, 12/4, or 12/6 Lennard-Jones potential,
|
||||
given by
|
||||
|
||||
:c,image(Eqs/pair_cmm.jpg)
|
||||
|
||||
as required for the CMM Coarse-grained MD parametrization discussed in
|
||||
"(Shinoda)"_#Shinoda and "(DeVane)"_#DeVane. Rc is the cutoff.
|
||||
|
||||
Style {cg/cmm/coul/cut} adds a Coulombic pairwise interaction given by
|
||||
|
||||
:c,image(Eqs/pair_coulomb.jpg)
|
||||
|
||||
where C is an energy-conversion constant, Qi and Qj are the charges on
|
||||
the 2 atoms, and epsilon is the dielectric constant which can be set
|
||||
by the "dielectric"_dielectric.html command. If one cutoff is
|
||||
specified in the pair_style command, it is used for both the LJ and
|
||||
Coulombic terms. If two cutoffs are specified, they are used as
|
||||
cutoffs for the LJ and Coulombic terms respectively.
|
||||
|
||||
This style also contains an additional exp() damping factor
|
||||
to the Coulombic term, given by
|
||||
|
||||
:c,image(Eqs/pair_debye.jpg)
|
||||
|
||||
where kappa is the Debye length (kappa=0.0 is the unscreened coulomb).
|
||||
This potential is another way to mimic the screening effect of a polar
|
||||
solvent.
|
||||
|
||||
Style {cg/cmm/coul/long} computes the same Coulombic interactions as
|
||||
style {cg/cmm/coul/cut} except that an additional damping factor is
|
||||
applied to the Coulombic term so it can be used in conjunction with
|
||||
the "kspace_style"_kspace_style.html command and its {ewald} or {pppm}
|
||||
option. The Coulombic cutoff specified for this style means that
|
||||
pairwise interactions within this distance are computed directly;
|
||||
interactions outside that distance are computed in reciprocal space.
|
||||
|
||||
The following coefficients must be defined for each pair of atoms
|
||||
types via the "pair_coeff"_pair_coeff.html command as in the examples
|
||||
above, or in the data file or restart files read by the
|
||||
"read_data"_read_data.html or "read_restart"_read_restart.html
|
||||
commands, or by mixing as described below:
|
||||
|
||||
cg_type (lj9_6, lj12_4, or lj12_6)
|
||||
epsilon (energy units)
|
||||
sigma (distance units)
|
||||
cutoff1 (distance units)
|
||||
cutoff2 (distance units) :ul
|
||||
|
||||
Note that sigma is defined in the LJ formula as the zero-crossing
|
||||
distance for the potential, not as the energy minimum. The prefactors
|
||||
are chosen so that the potential minimum is at -epsilon.
|
||||
|
||||
The latter 2 coefficients are optional. If not specified, the global
|
||||
LJ and Coulombic cutoffs specified in the pair_style command are used.
|
||||
If only one cutoff is specified, it is used as the cutoff for both LJ
|
||||
and Coulombic interactions for this type pair. If both coefficients
|
||||
are specified, they are used as the LJ and Coulombic cutoffs for this
|
||||
type pair.
|
||||
|
||||
For {cg/cmm/coul/long} only the LJ cutoff can be specified since a
|
||||
Coulombic cutoff cannot be specified for an individual I,J type pair.
|
||||
All type pairs use the same global Coulombic cutoff specified in the
|
||||
pair_style command.
|
||||
|
||||
:line
|
||||
|
||||
Styles with a {cuda}, {gpu}, or {opt} suffix are functionally the same
|
||||
as the corresponding style without the suffix. They have been
|
||||
optimized to run faster, depending on your available hardware, as
|
||||
discussed in "this section"_Section_accelerate.html of the manual.
|
||||
The accelerated styles take the same arguments and should produce the
|
||||
same results, except for round-off and precision issues.
|
||||
|
||||
These accelerated styles are part of the USER-CUDA, GPU, and OPT
|
||||
packages respectively. They are only enabled if LAMMPS was built with
|
||||
those packages. See the "Making LAMMPS"_Section_start.html#start_3
|
||||
section for more info.
|
||||
|
||||
You can specify the accelerated styles explicitly in your input script
|
||||
by including their suffix, or you can use the "-suffix command-line
|
||||
switch"_Section_start.html#start_6 when you invoke LAMMPS, or you can
|
||||
use the "suffix"_suffix.html command in your input script.
|
||||
|
||||
See "this section"_Section_accelerate.html of the manual for more
|
||||
instructions on how to use the accelerated styles effectively.
|
||||
|
||||
:line
|
||||
|
||||
[Mixing, shift, table, tail correction, restart, and rRESPA info]:
|
||||
|
||||
For atom type pairs I,J and I != J, the epsilon and sigma coefficients
|
||||
and cutoff distance for all of the cg/cmm pair styles {cannot} be mixed,
|
||||
since different pairs may have different exponents. So all parameters
|
||||
for all pairs have to be specified explicitly through the "pair_coeff"
|
||||
command. Defining then in a data file is also not supported, due to
|
||||
limitations of that file format.
|
||||
|
||||
All of the cg/cmm pair styles support the
|
||||
"pair_modify"_pair_modify.html shift option for the energy of the
|
||||
Lennard-Jones portion of the pair interaction.
|
||||
|
||||
The {cg/cmm/coul/long} pair styles support the
|
||||
"pair_modify"_pair_modify.html table option since they can tabulate
|
||||
the short-range portion of the long-range Coulombic interaction.
|
||||
|
||||
All of the cg/cmm pair styles write their information to "binary
|
||||
restart files"_restart.html, so pair_style and pair_coeff commands do
|
||||
not need to be specified in an input script that reads a restart file.
|
||||
|
||||
The cg/cmm, cg/cmm/coul/cut and lj/cut/coul/long pair styles support
|
||||
the use of the {inner}, {middle}, and {outer} keywords of the "run_style
|
||||
respa"_run_style.html command, meaning the pairwise forces can be
|
||||
partitioned by distance at different levels of the rRESPA hierarchy.
|
||||
See the "run_style"_run_style.html command for details.
|
||||
|
||||
:line
|
||||
|
||||
[Restrictions:]
|
||||
|
||||
All of the cg/cmm pair styles are part of the USER-CG-CMM package.
|
||||
The {cg/cmm/coul/long} style also requires the KSPACE package to be
|
||||
built (which is enabled by default). They are only enabled if LAMMPS
|
||||
was built with that package. See the "Making
|
||||
LAMMPS"_Section_start.html#start_3 section for more info.
|
||||
|
||||
[Related commands:]
|
||||
|
||||
"pair_coeff"_pair_coeff.html, "angle_style cg/cmm"_angle_cmm.html
|
||||
|
||||
[Default:] none
|
||||
|
||||
:line
|
||||
|
||||
:link(Shinoda)
|
||||
[(Shinoda)] Shinoda, DeVane, Klein, Mol Sim, 33, 27 (2007).
|
||||
|
||||
:link(DeVane)
|
||||
[(DeVane)] Shinoda, DeVane, Klein, Soft Matter, 4, 2453-2462 (2008).
|
||||
|
||||
Loading…
Reference in New Issue