{ "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" [ [ 0.252368 0.747632 0.252368 ] [ 0.252368 0.252368 0.747632 ] [ 0.747632 0.747632 0.747632 ] [ 0.747632 0.252368 0.252368 ] [ 0.745075 0.254925 0.745075 ] [ 0 0 0.5 ] [ 0.254925 0.254925 0.254925 ] [ 0.254925 0.745075 0.745075 ] [ 0 0.5 0 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0 0 ] [ 0.745075 0.745075 0.254925 ] [ 0 0.5 0.5 ] [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "species" { "source-value" [ "Bi" "Bi" "Bi" "Bi" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.76369001 "source-unit" "angstrom" } }