{ "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 0 0 ] [ 0.21984 0.78016 0.78016 ] [ 0.78016 0.78016 0.21984 ] [ 0.78016 0.21984 0.78016 ] [ 0.21984 0.21984 0.21984 ] [ 0.749828 0.749828 0.016303 ] [ 0.250172 0.983697 0.749828 ] [ 0.983697 0.250172 0.749828 ] [ 0.250172 0.016303 0.250172 ] [ 0.016303 0.250172 0.250172 ] [ 0.334518 0.334518 0.334518 ] [ 0.665482 0.334518 0.665482 ] [ 0.665482 0.665482 0.334518 ] [ 0.334518 0.665482 0.665482 ] [ 0.250172 0.250172 0.016303 ] [ 0.749828 0.016303 0.749828 ] [ 0.749828 0.983697 0.250172 ] [ 0.983697 0.749828 0.250172 ] [ 0.016303 0.749828 0.749828 ] [ 0.250172 0.749828 0.983697 ] [ 0.749828 0.250172 0.983697 ] ] } "species" { "source-value" [ "Hf" "B" "B" "B" "B" "H" "H" "H" "H" "H" "H" "H" "H" "H" "H" "H" "H" "H" "H" "H" "H" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.00892023 "source-unit" "angstrom" } }