git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@997 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2007-10-09 23:44:18 +00:00
parent 63464c4216
commit 2c33ed2d63
4 changed files with 14 additions and 14 deletions

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@ -83,11 +83,11 @@ hi-viscosity solvent and vice versa. See the discussion about gamma
and viscosity in the documentation for the <A HREF = "fix_viscous.html">fix and viscosity in the documentation for the <A HREF = "fix_viscous.html">fix
viscous</A> command for more details. viscous</A> command for more details.
</P> </P>
<P>The random # <I>seed</I> should be a non-zero integer with 1 to 8 digits. <P>The random # <I>seed</I> must be a positive integer. A Marsaglia random
A Marsaglia random number generator is used. Each processor uses the number generator is used. Each processor uses the input seed to
input seed to generate its own unique seed and its own stream of generate its own unique seed and its own stream of random numbers.
random numbers. Thus the dynamics of the system will not be identical Thus the dynamics of the system will not be identical on two runs on
on two runs on different numbers of processors. different numbers of processors.
</P> </P>
<P>The keyword <I>axes</I> can be used to specify which dimensions to add Ff <P>The keyword <I>axes</I> can be used to specify which dimensions to add Ff
and Fr to. A flag of 0 means skip that dimension; a flag of 1 means and Fr to. A flag of 0 means skip that dimension; a flag of 1 means

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@ -73,11 +73,11 @@ hi-viscosity solvent and vice versa. See the discussion about gamma
and viscosity in the documentation for the "fix and viscosity in the documentation for the "fix
viscous"_fix_viscous.html command for more details. viscous"_fix_viscous.html command for more details.
The random # {seed} should be a non-zero integer with 1 to 8 digits. The random # {seed} must be a positive integer. A Marsaglia random
A Marsaglia random number generator is used. Each processor uses the number generator is used. Each processor uses the input seed to
input seed to generate its own unique seed and its own stream of generate its own unique seed and its own stream of random numbers.
random numbers. Thus the dynamics of the system will not be identical Thus the dynamics of the system will not be identical on two runs on
on two runs on different numbers of processors. different numbers of processors.
The keyword {axes} can be used to specify which dimensions to add Ff The keyword {axes} can be used to specify which dimensions to add Ff
and Fr to. A flag of 0 means skip that dimension; a flag of 1 means and Fr to. A flag of 0 means skip that dimension; a flag of 1 means

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@ -35,12 +35,12 @@
<I>dipole</I> values = x y z <I>dipole</I> values = x y z
x,y,z = orientation of dipole moment vector x,y,z = orientation of dipole moment vector
<I>dipole/random</I> value = seed <I>dipole/random</I> value = seed
seed = random # seed (8 digits or less) for dipole moment orientations seed = random # seed (positive integer) for dipole moment orientations
<I>quat</I> values = a b c theta <I>quat</I> values = a b c theta
a,b,c = unit vector to rotate particle around via right-hand rule a,b,c = unit vector to rotate particle around via right-hand rule
theta = rotation angle in degrees theta = rotation angle in degrees
<I>quat/random</I> value = seed <I>quat/random</I> value = seed
seed = random # seed (8 digits or less) for quaternion orientations seed = random # seed (positive integer) for quaternion orientations
<I>bond</I> value = bond type for all bonds between selected atoms <I>bond</I> value = bond type for all bonds between selected atoms
<I>angle</I> value = angle type for all angles bewteen selected atoms <I>angle</I> value = angle type for all angles bewteen selected atoms
<I>dihedral</I> value = dihedral type for all dihedrals between selected atoms <I>dihedral</I> value = dihedral type for all dihedrals between selected atoms

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@ -31,12 +31,12 @@ keyword = {type} or {type/fraction} or {mol} or \
{dipole} values = x y z {dipole} values = x y z
x,y,z = orientation of dipole moment vector x,y,z = orientation of dipole moment vector
{dipole/random} value = seed {dipole/random} value = seed
seed = random # seed (8 digits or less) for dipole moment orientations seed = random # seed (positive integer) for dipole moment orientations
{quat} values = a b c theta {quat} values = a b c theta
a,b,c = unit vector to rotate particle around via right-hand rule a,b,c = unit vector to rotate particle around via right-hand rule
theta = rotation angle in degrees theta = rotation angle in degrees
{quat/random} value = seed {quat/random} value = seed
seed = random # seed (8 digits or less) for quaternion orientations seed = random # seed (positive integer) for quaternion orientations
{bond} value = bond type for all bonds between selected atoms {bond} value = bond type for all bonds between selected atoms
{angle} value = angle type for all angles bewteen selected atoms {angle} value = angle type for all angles bewteen selected atoms
{dihedral} value = dihedral type for all dihedrals between selected atoms {dihedral} value = dihedral type for all dihedrals between selected atoms