{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I-43d" } "basis-atom-coordinates" { "source-value" [ [ 0.125 0 0.75 ] [ 0.5 0.75 0.875 ] [ 0 0.75 0.125 ] [ 0.75 0.125 0 ] [ 0.75 0.875 0.5 ] [ 0.875 0.5 0.75 ] [ 0.625 0.5 0.25 ] [ 0 0.25 0.375 ] [ 0.5 0.25 0.625 ] [ 0.25 0.625 0.5 ] [ 0.25 0.375 0 ] [ 0.375 0 0.25 ] [ 0.829605 0.829605 0.829605 ] [ 0.579605 0.420395 0.920395 ] [ 0.420395 0.920395 0.579605 ] [ 0.920395 0.579605 0.420395 ] [ 0.170395 0.670395 0.829605 ] [ 0.670395 0.829605 0.170395 ] [ 0.079605 0.079605 0.079605 ] [ 0.829605 0.170395 0.670395 ] [ 0.329605 0.329605 0.329605 ] [ 0.079605 0.920395 0.420395 ] [ 0.920395 0.420395 0.079605 ] [ 0.420395 0.079605 0.920395 ] [ 0.670395 0.170395 0.329605 ] [ 0.170395 0.329605 0.670395 ] [ 0.579605 0.579605 0.579605 ] [ 0.329605 0.670395 0.170395 ] ] } "species" { "source-value" [ "U" "U" "U" "U" "U" "U" "U" "U" "U" "U" "U" "U" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.10222735471 "source-unit" "angstrom" } }