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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13806 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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<li>input = one or more atom attributes</li>
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</ul>
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<div class="highlight-python"><div class="highlight"><pre>possible attributes = id, mol, proc, type, mass,
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x, y, z, xs, ys, zs, xu, yu, zu, ix, iy, iz,
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vx, vy, vz, fx, fy, fz,
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q, mux, muy, muz, mu,
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radius, diameter, omegax, omegay, omegaz,
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angmomx, angmomy, angmomz,
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shapex,shapey, shapez,
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quatw, quati, quatj, quatk, tqx, tqy, tqz,
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end1x, end1y, end1z, end2x, end2y, end2z,
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corner1x, corner1y, corner1z,
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corner2x, corner2y, corner2z,
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corner3x, corner3y, corner3z,
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nbonds,
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vfrac, s0,
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spin, eradius, ervel, erforce,
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rho, drho, e, de, cv,
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i_name, d_name
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x, y, z, xs, ys, zs, xu, yu, zu, ix, iy, iz,
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vx, vy, vz, fx, fy, fz,
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q, mux, muy, muz, mu,
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radius, diameter, omegax, omegay, omegaz,
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angmomx, angmomy, angmomz,
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shapex,shapey, shapez,
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quatw, quati, quatj, quatk, tqx, tqy, tqz,
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end1x, end1y, end1z, end2x, end2y, end2z,
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corner1x, corner1y, corner1z,
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corner2x, corner2y, corner2z,
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corner3x, corner3y, corner3z,
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nbonds,
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vfrac, s0,
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spin, eradius, ervel, erforce,
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rho, drho, e, de, cv,
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i_name, d_name
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</pre></div>
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</div>
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<div class="highlight-python"><div class="highlight"><pre>id = atom ID
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mol = molecule ID
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proc = ID of processor that owns atom
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type = atom type
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mass = atom mass
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x,y,z = unscaled atom coordinates
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xs,ys,zs = scaled atom coordinates
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xu,yu,zu = unwrapped atom coordinates
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ix,iy,iz = box image that the atom is in
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vx,vy,vz = atom velocities
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fx,fy,fz = forces on atoms
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q = atom charge
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mux,muy,muz = orientation of dipole moment of atom
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mu = magnitude of dipole moment of atom
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radius,diameter = radius,diameter of spherical particle
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omegax,omegay,omegaz = angular velocity of spherical particle
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angmomx,angmomy,angmomz = angular momentum of aspherical particle
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shapex,shapey,shapez = 3 diameters of aspherical particle
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quatw,quati,quatj,quatk = quaternion components for aspherical or body particles
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tqx,tqy,tqz = torque on finite-size particles
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end12x, end12y, end12z = end points of line segment
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corner123x, corner123y, corner123z = corner points of triangle
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nbonds = number of bonds assigned to an atom
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mol = molecule ID
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proc = ID of processor that owns atom
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type = atom type
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mass = atom mass
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x,y,z = unscaled atom coordinates
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xs,ys,zs = scaled atom coordinates
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xu,yu,zu = unwrapped atom coordinates
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ix,iy,iz = box image that the atom is in
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vx,vy,vz = atom velocities
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fx,fy,fz = forces on atoms
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q = atom charge
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mux,muy,muz = orientation of dipole moment of atom
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mu = magnitude of dipole moment of atom
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radius,diameter = radius,diameter of spherical particle
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omegax,omegay,omegaz = angular velocity of spherical particle
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angmomx,angmomy,angmomz = angular momentum of aspherical particle
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shapex,shapey,shapez = 3 diameters of aspherical particle
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quatw,quati,quatj,quatk = quaternion components for aspherical or body particles
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tqx,tqy,tqz = torque on finite-size particles
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end12x, end12y, end12z = end points of line segment
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corner123x, corner123y, corner123z = corner points of triangle
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nbonds = number of bonds assigned to an atom
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</pre></div>
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</div>
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<div class="highlight-python"><div class="highlight"><pre>PERI package per-atom properties:
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vfrac = ???
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s0 = ???
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vfrac = ???
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s0 = ???
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</pre></div>
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</div>
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<div class="highlight-python"><div class="highlight"><pre>USER-EFF and USER-AWPMD package per-atom properties:
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spin = electron spin
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eradius = electron radius
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ervel = electron radial velocity
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erforce = electron radial force
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spin = electron spin
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eradius = electron radius
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ervel = electron radial velocity
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erforce = electron radial force
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</pre></div>
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</div>
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<div class="highlight-python"><div class="highlight"><pre>USER-SPH package per-atom properties:
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rho = ???
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drho = ???
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e = ???
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de = ???
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cv = ???
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rho = ???
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drho = ???
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e = ???
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de = ???
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cv = ???
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</pre></div>
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</div>
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<pre class="literal-block">
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<a class="reference internal" href="fix_property_atom.html"><em>fix property/atom</em></a> per-atom properties:
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i_name = custom integer vector with name
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d_name = custom integer vector with name
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i_name = custom integer vector with name
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d_name = custom integer vector with name
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</pre>
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</div>
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<div class="section" id="examples">
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