{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2cm" } "basis-atom-coordinates" { "source-value" [ [ 0.447681 0.029687 0.619639 ] [ 0.447681 0.970313 0.380361 ] [ 0.447681 0.970313 0.119639 ] [ 0.447681 0.029687 0.880361 ] [ 0.519759 0.638838 0.629014 ] [ 0.519759 0.361162 0.370986 ] [ 0.519759 0.361162 0.129014 ] [ 0.519759 0.638838 0.870986 ] [ 0.019 0.979209 0.75 ] [ 0.019 0.020791 0.25 ] [ 0.10629 0.375261 0.75 ] [ 0.10629 0.624739 0.25 ] [ 0.906829 0.697084 0.006468 ] [ 0.906829 0.302916 0.993532 ] [ 0.906829 0.302916 0.506468 ] [ 0.906829 0.697084 0.493532 ] [ 0.493464 0.333191 0.62599 ] [ 0.493464 0.666809 0.37401 ] [ 0.493464 0.666809 0.12599 ] [ 0.493464 0.333191 0.87401 ] [ 0.009645 0.324779 0.25 ] [ 0.009645 0.675221 0.75 ] [ 0.959597 0 0.5 ] [ 0.959597 0 0 ] ] } "species" { "source-value" [ "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.51262296 "source-unit" "angstrom" } "b" { "source-value" 8.95260203 "source-unit" "angstrom" } "c" { "source-value" 16.87999321 "source-unit" "angstrom" } }