{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Im3" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0.5 0.341138 0.158706 ] [ 0.5 0.658862 0.841294 ] [ 0.841138 0.341294 0 ] [ 0.658706 0 0.158862 ] [ 0.341138 0.158706 0.5 ] [ 0.341294 0 0.841138 ] [ 0.158862 0.658706 0 ] [ 0.158706 0.5 0.341138 ] [ 0.841294 0.5 0.658862 ] [ 0.658862 0.841294 0.5 ] [ 0 0.841138 0.341294 ] [ 0 0.158862 0.658706 ] [ 0 0.841138 0.658706 ] [ 0 0.158862 0.341294 ] [ 0.341138 0.841294 0.5 ] [ 0.158706 0.5 0.658862 ] [ 0.841138 0.658706 0 ] [ 0.841294 0.5 0.341138 ] [ 0.658862 0.158706 0.5 ] [ 0.658706 0 0.841138 ] [ 0.341294 0 0.158862 ] [ 0.158862 0.341294 0 ] [ 0.5 0.341138 0.841294 ] [ 0.5 0.658862 0.158706 ] [ 0.75 0.75 0.75 ] [ 0.25 0.75 0.75 ] [ 0.75 0.25 0.75 ] [ 0.75 0.75 0.25 ] [ 0.25 0.25 0.25 ] [ 0.75 0.25 0.25 ] [ 0.25 0.75 0.25 ] [ 0.25 0.25 0.75 ] ] } "species" { "source-value" [ "Eu" "Eu" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.40701992329 "source-unit" "angstrom" } }