{ "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 0.993004 0.674486 ] [ 0.75 0.006996 0.325514 ] [ 0.25 0.493004 0.825514 ] [ 0.75 0.506996 0.174486 ] [ 0.75 0.149922 0.91371 ] [ 0.25 0.850078 0.08629 ] [ 0.75 0.649922 0.58629 ] [ 0.25 0.350078 0.41371 ] [ 0.25 0.759144 0.403725 ] [ 0.75 0.240856 0.596275 ] [ 0.25 0.259144 0.096275 ] [ 0.75 0.740856 0.903725 ] ] } "species" { "source-value" [ "Pr" "Pr" "Pr" "Pr" "Pr" "Pr" "Pr" "Pr" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.15280749 "source-unit" "angstrom" } "b" { "source-value" 7.40620526 "source-unit" "angstrom" } "c" { "source-value" 9.42382567 "source-unit" "angstrom" } }