{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.876922 0.122906 0.026663 ] [ 0.376112 0.875623 0.47302 ] [ 0.123078 0.622906 0.973337 ] [ 0.623888 0.375623 0.52698 ] [ 0.08015 0.856681 0.21625 ] [ 0.422859 0.641915 0.71706 ] [ 0.577141 0.141915 0.28294 ] [ 0.378469 0.330358 0.116964 ] [ 0.774288 0.430947 0.203102 ] [ 0.640688 0.501988 0.944638 ] [ 0.882647 0.666375 0.38444 ] [ 0.860561 0.995432 0.43765 ] [ 0.708865 0.066533 0.698443 ] [ 0.359312 0.001988 0.055362 ] [ 0.621531 0.830358 0.883036 ] [ 0.117353 0.166375 0.61556 ] [ 0.139439 0.495432 0.56235 ] [ 0.91985 0.356681 0.78375 ] [ 0.225712 0.930947 0.796898 ] [ 0.291135 0.566533 0.301557 ] [ 0.375291 0.25441 0.837139 ] [ 0.116829 0.2529 0.339294 ] [ 0.883171 0.7529 0.660706 ] [ 0.624709 0.75441 0.162861 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Sn" "Sn" "Sn" "Sn" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.78284999645 "source-unit" "angstrom" } "b" { "source-value" 7.91878525222 "source-unit" "angstrom" } "c" { "source-value" 9.17768679405 "source-unit" "angstrom" } "beta" { "source-value" 90.0650678415 "source-unit" "degree" } }