{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.924211 0.5 0.281277 ] [ 0.075789 0.5 0.718723 ] [ 0.424211 0 0.281277 ] [ 0.575789 0 0.718723 ] [ 0.137103 0 0.433067 ] [ 0.786268 0.5 0.854718 ] [ 0.213732 0.5 0.145282 ] [ 0.862897 0 0.566933 ] [ 0 0 0 ] [ 0.637103 0.5 0.433067 ] [ 0.286268 0 0.854718 ] [ 0.713732 0 0.145282 ] [ 0.362897 0.5 0.566933 ] [ 0.5 0.5 0 ] ] } "species" { "source-value" [ "Mn" "Mn" "Mn" "Mn" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.2993309823 "source-unit" "angstrom" } "b" { "source-value" 3.93810311 "source-unit" "angstrom" } "c" { "source-value" 6.63498505541 "source-unit" "angstrom" } "beta" { "source-value" 97.030441985 "source-unit" "degree" } }