{ "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" [ [ 0.2423 0.75 0.077216 ] [ 0.747213 0.994531 0.247205 ] [ 0.747213 0.505469 0.247205 ] [ 0.252787 0.494531 0.752795 ] [ 0.252787 0.005469 0.752795 ] [ 0.7577 0.25 0.922784 ] [ 0.29045 0.75 0.423068 ] [ 0.70955 0.25 0.576932 ] [ 0.216243 0.25 0.340686 ] [ 0.783757 0.75 0.659314 ] [ 0.267087 0.25 0.060912 ] [ 0.732913 0.75 0.939088 ] [ 0.699775 0.75 0.085043 ] [ 0.031226 0.25 0.129183 ] [ 0.470073 0.25 0.165123 ] [ 0.216736 0.94108 0.319789 ] [ 0.216736 0.55892 0.319789 ] [ 0.599404 0.75 0.458385 ] [ 0.853922 0.25 0.419519 ] [ 0.146078 0.75 0.580481 ] [ 0.400596 0.25 0.541615 ] [ 0.783264 0.44108 0.680211 ] [ 0.783264 0.05892 0.680211 ] [ 0.529927 0.75 0.834877 ] [ 0.968774 0.75 0.870817 ] [ 0.300225 0.25 0.914957 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Si" "Si" "Sn" "Sn" "B" "B" "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" 5.31303828 "source-unit" "angstrom" } "b" { "source-value" 6.77297868 "source-unit" "angstrom" } "c" { "source-value" 9.11599859 "source-unit" "angstrom" } "beta" { "source-value" 91.07126591 "source-unit" "degree" } }