{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] [ 0.688835 0.209546 0.926694 ] [ 0.311165 0.709546 0.573306 ] [ 0.311165 0.790454 0.073306 ] [ 0.688835 0.290454 0.426694 ] [ 0.831378 0.817005 0.663703 ] [ 0.168622 0.317005 0.836297 ] [ 0.168622 0.182995 0.336297 ] [ 0.831378 0.682995 0.163703 ] ] } "species" { "source-value" [ "U" "U" "Cu" "Cu" "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" 5.51773239952 "source-unit" "angstrom" } "b" { "source-value" 5.02529706 "source-unit" "angstrom" } "c" { "source-value" 6.27100119478 "source-unit" "angstrom" } "beta" { "source-value" 111.727562494 "source-unit" "degree" } }