{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/c" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.336042 0.75 ] [ 0.5 0.663958 0.25 ] [ 0 0.819406 0.75 ] [ 0 0.180594 0.25 ] [ 0.258937 0.62457 0.59906 ] [ 0.741063 0.62457 0.90094 ] [ 0.741063 0.37543 0.40094 ] [ 0.258937 0.37543 0.09906 ] [ 0.218456 0.890527 0.068714 ] [ 0.781544 0.890527 0.431286 ] [ 0.781544 0.109473 0.931286 ] [ 0.218456 0.109473 0.568714 ] ] } "species" { "source-value" [ "Co" "Co" "Mo" "Mo" "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" 4.6903890509 "source-unit" "angstrom" } "b" { "source-value" 5.77316071 "source-unit" "angstrom" } "c" { "source-value" 4.99426815768 "source-unit" "angstrom" } "beta" { "source-value" 90.2096153122 "source-unit" "degree" } }