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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11838 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2014-04-29 22:23:31 +00:00
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18
doc/compute_voronoi_atom.html
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@ -113,16 +113,16 @@ performed for the first invocation of the compute and then stored.
For all following invocations of the compute the number of atoms in
each Voronoi cell in the stored tessellation is counted. In this mode
the compute returns a per-atom array with 2 columns. The first column
is the number of atoms currently in the Voronoi volume defined by this
atom at the time of the first invocation of the compute (note that the
is the number of atoms currently in the Voronoi volume defined by this
atom at the time of the first invocation of the compute (note that the
atom may have moved significantly). The second column contains the
total number of atoms sharing the Voronoi cell of the stored
tessellation at the location of the current atom. Numbers in column one
can be any positive integer including zero, while column two values will
always be greater than zero. Column one data can be used to locate
vacancies (the coordinates are given by the atom coordinates at the
time step when the compute was first invoked), while column two data
can be used to identify interstitial atoms.
total number of atoms sharing the Voronoi cell of the stored
tessellation at the location of the current atom. Numbers in column
one can be any positive integer including zero, while column two
values will always be greater than zero. Column one data can be used
to locate vacancies (the coordinates are given by the atom coordinates
at the time step when the compute was first invoked), while column two
data can be used to identify interstitial atoms.
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