{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0.845306 0.169501 0.25 ] [ 0.154694 0.830499 0.75 ] [ 0.154694 0.169501 0.75 ] [ 0.845306 0.830499 0.25 ] [ 0.345306 0.669501 0.25 ] [ 0.654694 0.330499 0.75 ] [ 0.654694 0.669501 0.75 ] [ 0.345306 0.330499 0.25 ] [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.25056 0 0.25 ] [ 0.74944 0 0.75 ] [ 0.75056 0.5 0.25 ] [ 0.24944 0.5 0.75 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "K" "K" "Cu" "Cu" "Cu" "Cu" "Sb" "Sb" "Sb" "Sb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.96354669044 "source-unit" "angstrom" } "b" { "source-value" 10.6061337933 "source-unit" "angstrom" } "c" { "source-value" 6.25840339 "source-unit" "angstrom" } }