{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-43m" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0.5 ] [ 0 0 0 ] [ 0.1997 0.8003 0.8003 ] [ 0.8003 0.8003 0.1997 ] [ 0.1997 0.1997 0.1997 ] [ 0.8003 0.1997 0.8003 ] [ 0.696008 0.696008 0.303992 ] [ 0.303992 0.696008 0.696008 ] [ 0.303992 0.303992 0.303992 ] [ 0.696008 0.303992 0.696008 ] ] } "species" { "source-value" [ "Cd" "Cd" "C" "C" "C" "C" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.46263051 "source-unit" "angstrom" } }