(3df8b6e3) · Commits · 郑智淋 / lammps

doc/compute_erotate_asphere.html

+11 −0

Original line number	Diff line number	Diff line
		@@ -47,8 +47,19 @@ ellipsoids and not point particles. This means they will have an
		angular momentum and a shape which is determined by the
		<A HREF = "shape.html">shape</A> command.
		</P>
		<P>This compute requires that atoms store angular momentum and a
		quaternion to represent their orientation, as defined by the
		<A HREF = "atom_style.html">atom_style</A>. It also require they store a per-type
		<A HREF = "shape.html">shape</A>. The particles cannot store a per-particle
		diameter or per-particle mass.
		</P>
		<P>All particles in the group must be finite-size. They cannot be point
		particles, but they can be aspherical or spherical.
		</P>
		<P><B>Related commands:</B> none
		</P>
		<P><A HREF = "compute_rotate_sphere.html">compute erotate/sphere</A>
		</P>
		<P><B>Default:</B> none
		</P>
		</HTML>

+11 −0

Original line number	Diff line number	Diff line
		@@ -44,6 +44,17 @@ ellipsoids and not point particles. This means they will have an
		angular momentum and a shape which is determined by the
		"shape"_shape.html command.

		This compute requires that atoms store angular momentum and a
		quaternion to represent their orientation, as defined by the
		"atom_style"_atom_style.html. It also require they store a per-type
		"shape"_shape.html. The particles cannot store a per-particle
		diameter or per-particle mass.

		All particles in the group must be finite-size. They cannot be point
		particles, but they can be aspherical or spherical.

		[Related commands:] none

		"compute erotate/sphere"_compute_rotate_sphere.html

		[Default:] none

+10 −6

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		@@ -41,13 +41,17 @@ it scales with the number of atoms in the simulation.
		</P>
		<P><B>Restrictions:</B>
		</P>
		<P>This compute requires that particles be represented as extended
		spheres and not point particles. This means they will have an angular
		velocity and a diameter which is determined either by the
		<A HREF = "shape.html">shape</A> command or by each particle being assigned an
		individual radius, e.g. for <A HREF = "atom_style.html">atom_style granular</A>.
		<P>This compute requires that atoms store angular velocity (omega) as
		defined by the <A HREF = "atom_style.html">atom_style</A>. It also require they
		store either a per-particle diameter or per-type <A HREF = "shape.html">shape</A>.
		</P>
		<P><B>Related commands:</B> none
		<P>All particles in the group must be finite-size spheres or point
		particles. They cannot be aspherical. Point particles will not
		contribute to the rotational energy.
		</P>
		<P><B>Related commands:</B>
		</P>
		<P><A HREF = "compute_rotate_asphere.html">compute erotate/asphere</A>
		</P>
		<P><B>Default:</B> none
		</P>

+10 −6

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		@@ -38,12 +38,16 @@ it scales with the number of atoms in the simulation.

		[Restrictions:]

		This compute requires that particles be represented as extended
		spheres and not point particles. This means they will have an angular
		velocity and a diameter which is determined either by the
		"shape"_shape.html command or by each particle being assigned an
		individual radius, e.g. for "atom_style granular"_atom_style.html.
		This compute requires that atoms store angular velocity (omega) as
		defined by the "atom_style"_atom_style.html. It also require they
		store either a per-particle diameter or per-type "shape"_shape.html.

		[Related commands:] none
		All particles in the group must be finite-size spheres or point
		particles. They cannot be aspherical. Point particles will not
		contribute to the rotational energy.

		[Related commands:]

		"compute erotate/asphere"_compute_rotate_asphere.html

		[Default:] none

+8 −4

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		@@ -217,10 +217,14 @@ this.
		LAMMPS was built with that package. See the <A HREF = "Section_start.html#2_3">Making
		LAMMPS</A> section for more info.
		</P>
		<P>This fix requires that particles be represented as extended ellipsoids
		and not point particles. This means they will have an angular
		momentum and a shape which is determined by the <A HREF = "shape.html">shape</A>
		command.
		<P>This fix requires that atoms store torque and angular momentum and a
		quaternion to represent their orientation, as defined by the
		<A HREF = "atom_style.html">atom_style</A>. It also require they store a per-type
		<A HREF = "shape.html">shape</A>. The particles cannot store a per-particle
		diameter or per-particle mass.
		</P>
		<P>All particles in the group must be finite-size. They cannot be point
		particles, but they can be aspherical or spherical.
		</P>
		<P>Any dimension being adjusted by this fix must be periodic. A
		dimension whose target pressures are specified as NULL can be