{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Imcm" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0 0.284599 ] [ 0.25 0.5 0.215401 ] [ 0.75 0.5 0.784599 ] [ 0.75 0 0.715401 ] [ 0.25 0.216963 0.913521 ] [ 0.25 0.283037 0.586479 ] [ 0.75 0.283037 0.413521 ] [ 0.75 0.216963 0.086479 ] [ 0.75 0.716963 0.413521 ] [ 0.75 0.783037 0.086479 ] [ 0.25 0.783037 0.913521 ] [ 0.25 0.716963 0.586479 ] ] } "species" { "source-value" [ "Pr" "Pr" "Pr" "Pr" "Au" "Au" "Au" "Au" "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" 4.72600334147 "source-unit" "angstrom" } "b" { "source-value" 7.23070643046 "source-unit" "angstrom" } "c" { "source-value" 8.37270134365 "source-unit" "angstrom" } }