{ "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" [ [ 0.770811 0.229189 0.229189 ] [ 0.229189 0.770811 0.229189 ] [ 0.770811 0.770811 0.770811 ] [ 0.229189 0.229189 0.770811 ] [ 0.5 0.5 0.5 ] [ 0.366449 0.366449 0.366449 ] [ 0.633551 0.633551 0.366449 ] [ 0.366449 0.633551 0.633551 ] [ 0.633551 0.366449 0.633551 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "C" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.24018098 "source-unit" "angstrom" } }