{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.766498 0.25 0.083975 ] [ 0.250186 0.001407 0.256828 ] [ 0.250186 0.498593 0.256828 ] [ 0.749814 0.501407 0.743172 ] [ 0.749814 0.998593 0.743172 ] [ 0.233502 0.75 0.916025 ] [ 0.778844 0.75 0.363271 ] [ 0.221156 0.25 0.636729 ] [ 0.707981 0.25 0.403783 ] [ 0.292019 0.75 0.596217 ] [ 0.729993 0.75 0.054988 ] [ 0.270007 0.25 0.945012 ] [ 0.272814 0.25 0.084557 ] [ 0.954133 0.75 0.126369 ] [ 0.514524 0.75 0.125504 ] [ 0.802929 0.073767 0.318626 ] [ 0.802929 0.426233 0.318626 ] [ 0.405831 0.25 0.407387 ] [ 0.185199 0.75 0.434969 ] [ 0.814801 0.25 0.565031 ] [ 0.594169 0.75 0.592613 ] [ 0.197071 0.573767 0.681374 ] [ 0.197071 0.926233 0.681374 ] [ 0.485476 0.25 0.874496 ] [ 0.045867 0.25 0.873631 ] [ 0.727186 0.75 0.915443 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Ge" "Ge" "P" "P" "C" "C" "O" "O" "O" "O" "O" "O" "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" 5.15306241 "source-unit" "angstrom" } "b" { "source-value" 7.06796168 "source-unit" "angstrom" } "c" { "source-value" 9.24403729 "source-unit" "angstrom" } "beta" { "source-value" 91.15373317 "source-unit" "degree" } }