{ "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" [ [ 0.177468 0.191158 0.25 ] [ 0.822532 0.808842 0.75 ] [ 0.177468 0.808842 0.25 ] [ 0.822532 0.191158 0.75 ] [ 0.677468 0.691158 0.25 ] [ 0.322532 0.308842 0.75 ] [ 0.677468 0.308842 0.25 ] [ 0.322532 0.691158 0.75 ] [ 0.82641 0 0.25 ] [ 0.17359 0 0.75 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0.32641 0.5 0.25 ] [ 0.67359 0.5 0.75 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "Ce" "Ce" "Ce" "Ce" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.48084967323 "source-unit" "angstrom" } "b" { "source-value" 9.35936472734 "source-unit" "angstrom" } "c" { "source-value" 5.37226805 "source-unit" "angstrom" } }