From c110bf1f6a8dec4707a545dd8af404e490f487ef Mon Sep 17 00:00:00 2001 From: sjplimp Date: Tue, 24 Jun 2008 17:28:12 +0000 Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1919 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- doc/dump.html | 29 +++++++++++++++++++---------- doc/dump.txt | 29 +++++++++++++++++++---------- 2 files changed, 38 insertions(+), 20 deletions(-) diff --git a/doc/dump.html b/doc/dump.html index 8f1f2d6d2e..0e362ba388 100644 --- a/doc/dump.html +++ b/doc/dump.html @@ -38,6 +38,7 @@ vx, vy, vz, fx, fy, fz, q, mux, muy, muz, radius, omegax, omegay, omegaz, + angmomx, angmomy, angmomz, quatw, quati, quatj, quatk, tqx, tqy, tqz, c_ID, c_ID[N], f_ID, f_ID[N], v_name tag = atom ID @@ -51,10 +52,11 @@ fx,fy,fz = forces on atoms q = atom charge mux,muy,muz = orientation of dipolar atom - radius = radius of extended spherical atom - omegax,omegay,omegaz = angular velocity of extended atom + radius = radius of extended spherical particle + omegax,omegay,omegaz = angular velocity of extended particle + angmomx,angmomy,angmomz = angular momentum of extended particle quatw,quati,quatj,quatk = quaternion components for aspherical particles - tqx,tqy,tqz = torque on aspherical particles + tqx,tqy,tqz = torque on extended particles c_ID = per-atom scalar value calculated by a compute with ID c_ID[N] = Nth component of per-atom vector calculated by a compute with ID f_ID = per-atom scalar value calculated by a fix with ID @@ -246,7 +248,7 @@ is meant by scaled vs unscaled coordinates and the image flags.

The mux, muy, muz keywords are specific to dipolar systems defined with an atom style of dipole. They give the orientation of -the atom's dipole. +the atom's point dipole moment.

The radius keyword is specific to extended spherical particles that have a finite size, such as granular particles defined with @@ -254,14 +256,21 @@ an atom style of granular.

The omegax, omegay, and omegaz keywords are specific to extended spherical or aspherical particles that have an angular velocity. Only -certain atom styles, such as granular or ellipsoid define this +certain atom styles, such as granular or dipole define this quantity.

-

The quatw, quati, quatj, quatk, tqx, tqy, tqz keywords -are specific to aspherical particles defined with an atom style of -ellipsoid. The first 4 are the components of the quaternion that -define the orientation of the particle. The final 3 give the -rotational torque on the particle. +

The angmomx, angmomy, and angmomz keywords are specific to +extended aspherical particles that have an angular momentum. Only +the ellipsoid) atom style defines this quantity. +

+

The quatw, quati, quatj, quatk keywords are for aspherical +particles defined with an atom style of ellipsoid. They are the +components of the quaternion that defines the orientation of the +particle. +

+

The tqx, tqy, tqz keywords are for extended spherical or +aspherical particles that can sustain a rotational torque due +to interactions with other particles.

The c_ID and c_ID[N] keywords allow scalar or vector per-atom quantities calculated by a compute to be output. The diff --git a/doc/dump.txt b/doc/dump.txt index ae07f777eb..b700d71fec 100644 --- a/doc/dump.txt +++ b/doc/dump.txt @@ -29,6 +29,7 @@ args = list of arguments for a particular style :l vx, vy, vz, fx, fy, fz, q, mux, muy, muz, radius, omegax, omegay, omegaz, + angmomx, angmomy, angmomz, quatw, quati, quatj, quatk, tqx, tqy, tqz, c_ID, c_ID\[N\], f_ID, f_ID\[N\], v_name tag = atom ID @@ -42,10 +43,11 @@ args = list of arguments for a particular style :l fx,fy,fz = forces on atoms q = atom charge mux,muy,muz = orientation of dipolar atom - radius = radius of extended spherical atom - omegax,omegay,omegaz = angular velocity of extended atom + radius = radius of extended spherical particle + omegax,omegay,omegaz = angular velocity of extended particle + angmomx,angmomy,angmomz = angular momentum of extended particle quatw,quati,quatj,quatk = quaternion components for aspherical particles - tqx,tqy,tqz = torque on aspherical particles + tqx,tqy,tqz = torque on extended particles c_ID = per-atom scalar value calculated by a compute with ID c_ID\[N\] = Nth component of per-atom vector calculated by a compute with ID f_ID = per-atom scalar value calculated by a fix with ID @@ -236,7 +238,7 @@ is meant by scaled vs unscaled coordinates and the image flags. The {mux}, {muy}, {muz} keywords are specific to dipolar systems defined with an atom style of {dipole}. They give the orientation of -the atom's dipole. +the atom's point dipole moment. The {radius} keyword is specific to extended spherical particles that have a finite size, such as granular particles defined with @@ -244,14 +246,21 @@ an atom style of {granular}. The {omegax}, {omegay}, and {omegaz} keywords are specific to extended spherical or aspherical particles that have an angular velocity. Only -certain atom styles, such as {granular} or {ellipsoid} define this +certain atom styles, such as {granular} or {dipole} define this quantity. -The {quatw}, {quati}, {quatj}, {quatk}, {tqx}, {tqy}, {tqz} keywords -are specific to aspherical particles defined with an atom style of -{ellipsoid}. The first 4 are the components of the quaternion that -define the orientation of the particle. The final 3 give the -rotational torque on the particle. +The {angmomx}, {angmomy}, and {angmomz} keywords are specific to +extended aspherical particles that have an angular momentum. Only +the {ellipsoid) atom style defines this quantity. + +The {quatw}, {quati}, {quatj}, {quatk} keywords are for aspherical +particles defined with an atom style of {ellipsoid}. They are the +components of the quaternion that defines the orientation of the +particle. + +The {tqx}, {tqy}, {tqz} keywords are for extended spherical or +aspherical particles that can sustain a rotational torque due +to interactions with other particles. The {c_ID} and {c_ID\[N\]} keywords allow scalar or vector per-atom quantities calculated by a "compute"_compute.html to be output. The