{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.508853 0.309923 ] [ 0.75 0.491147 0.690077 ] [ 0.25 0.008853 0.190077 ] [ 0.75 0.991147 0.809923 ] [ 0.25 0.682683 0.935554 ] [ 0.75 0.317317 0.064446 ] [ 0.25 0.182683 0.564446 ] [ 0.75 0.817317 0.435554 ] ] } "species" { "source-value" [ "Cr" "Cr" "Cr" "Cr" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.06317917 "source-unit" "angstrom" } "b" { "source-value" 5.3345639 "source-unit" "angstrom" } "c" { "source-value" 5.94818906 "source-unit" "angstrom" } }