{ "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" [ [ 0.277719 0.360056 0.887118 ] [ 0.722281 0.860056 0.612882 ] [ 0.277719 0.139944 0.387118 ] [ 0.722281 0.639944 0.112882 ] [ 0.295662 0.517204 0.48723 ] [ 0.295662 0.982796 0.98723 ] [ 0.704338 0.017204 0.01277 ] [ 0.704338 0.482796 0.51277 ] [ 0 0.5 0.5 ] [ 0 0 0 ] [ 0.425434 0.061918 0.791736 ] [ 0.574566 0.561918 0.708264 ] [ 0.425434 0.438082 0.291736 ] [ 0.574566 0.938082 0.208264 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Be" "Be" "Be" "Be" "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" 4.96194871 "source-unit" "angstrom" } "b" { "source-value" 7.26879776 "source-unit" "angstrom" } "c" { "source-value" 5.75444983 "source-unit" "angstrom" } "beta" { "source-value" 108.68948512 "source-unit" "degree" } }