git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2003 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
@ -48,6 +48,10 @@ or <A HREF = "read_restart.html">read_restart</A> commands:
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"molecular" package (which it is by default). See the <A HREF = "Section_start.html#2_3">Making
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LAMMPS</A> section for more info on packages.
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</P>
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<P>You typically should specify <A HREF = "special_bonds.html">special_bonds 0 1 1</A>
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to use this bond style. LAMMPS will issue a warning it that's not the
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case.
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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 = "bond_coeff.html">bond_coeff</A>, <A HREF = "delete_bonds.html">delete_bonds</A>
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@ -45,6 +45,10 @@ This bond style can only be used if LAMMPS was built with the
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"molecular" package (which it is by default). See the "Making
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LAMMPS"_Section_start.html#2_3 section for more info on packages.
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You typically should specify "special_bonds 0 1 1"_special_bonds.html
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to use this bond style. LAMMPS will issue a warning it that's not the
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case.
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[Related commands:]
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"bond_coeff"_bond_coeff.html, "delete_bonds"_delete_bonds.html
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@ -53,6 +53,10 @@ or <A HREF = "read_restart.html">read_restart</A> commands:
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"molecular" package (which it is by default). See the <A HREF = "Section_start.html#2_3">Making
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LAMMPS</A> section for more info on packages.
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</P>
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<P>You typically should specify <A HREF = "special_bonds.html">special_bonds 0 1 1</A>
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to use this bond style. LAMMPS will issue a warning it that's not the
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case.
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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 = "bond_coeff.html">bond_coeff</A>, <A HREF = "delete_bonds.html">delete_bonds</A>
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@ -50,6 +50,10 @@ This bond style can only be used if LAMMPS was built with the
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"molecular" package (which it is by default). See the "Making
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LAMMPS"_Section_start.html#2_3 section for more info on packages.
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You typically should specify "special_bonds 0 1 1"_special_bonds.html
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to use this bond style. LAMMPS will issue a warning it that's not the
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case.
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[Related commands:]
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"bond_coeff"_bond_coeff.html, "delete_bonds"_delete_bonds.html
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@ -23,7 +23,7 @@
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</UL>
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<P><B>Examples:</B>
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</P>
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<PRE>fix 1 all bond/swap 0.5 1.5 598934
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<PRE>fix 1 all bond/swap 0.5 1.3 598934
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</PRE>
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<P><B>Description:</B>
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</P>
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@ -20,7 +20,7 @@ seed = random # seed (positive integer) :ul
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[Examples:]
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fix 1 all bond/swap 0.5 1.5 598934 :pre
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fix 1 all bond/swap 0.5 1.3 598934 :pre
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[Description:]
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@ -24,7 +24,7 @@ special_bonds c1 c2 c3 c4 c5 c6
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</P>
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<PRE>special_bonds charmm
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special_bonds amber
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special_bonds 0.0 0.0 1.0
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special_bonds 0 1 1
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special_bonds 0.0 0.0 1.0 0.0 0.0 0.5
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</PRE>
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<P><B>Description:</B>
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@ -65,6 +65,9 @@ interactions and to 0.0 0.0 0.833 for Coulombic interactions, which is
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the default for a particular version of the AMBER force field, where
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the last value is 5/6.
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</P>
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<P>For a <A HREF = "units.html">lj units</A> system with <A HREF = "bond_fene.html">FENE bonds</A> a
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setting of special bonds 0 1 1 should be used.
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</P>
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<P>A special_bonds command with 3 coefficients sets the 1-2, 1-3, and 1-4
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coefficients for both LJ and Coulombic terms to those values.
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</P>
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@ -21,7 +21,7 @@ Examples:
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special_bonds charmm
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special_bonds amber
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special_bonds 0.0 0.0 1.0
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special_bonds 0 1 1
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special_bonds 0.0 0.0 1.0 0.0 0.0 0.5 :pre
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[Description:]
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@ -62,6 +62,9 @@ interactions and to 0.0 0.0 0.833 for Coulombic interactions, which is
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the default for a particular version of the AMBER force field, where
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the last value is 5/6.
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For a "lj units"_units.html system with "FENE bonds"_bond_fene.html a
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setting of special bonds 0 1 1 should be used.
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A special_bonds command with 3 coefficients sets the 1-2, 1-3, and 1-4
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coefficients for both LJ and Coulombic terms to those values.
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