{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Immm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0.166219 ] [ 0.5 0.5 0.833781 ] [ 0 0 0.666219 ] [ 0 0 0.333781 ] [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0 0.754298 0.160115 ] [ 0.5 0.765784 0 ] [ 0 0.245702 0.160115 ] [ 0 0.754298 0.839885 ] [ 0.5 0.234216 0 ] [ 0 0.245702 0.839885 ] [ 0.5 0.254298 0.660115 ] [ 0 0.265784 0.5 ] [ 0.5 0.745702 0.660115 ] [ 0.5 0.254298 0.339885 ] [ 0 0.734216 0.5 ] [ 0.5 0.745702 0.339885 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "U" "U" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.87184497 "source-unit" "angstrom" } "b" { "source-value" 5.46651104 "source-unit" "angstrom" } "c" { "source-value" 11.4755587 "source-unit" "angstrom" } }