{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.993124 0.511652 0.997862 ] [ 0.554493 0.808664 0.831381 ] [ 0.503911 0.509043 0.511738 ] [ 0.496089 0.009043 0.488262 ] [ 0.445507 0.308664 0.168619 ] [ 0.006876 0.011652 0.002138 ] [ 0.98297 0.259829 0.700879 ] [ 0.01703 0.759829 0.299121 ] [ 0.019813 0.760051 0.654006 ] [ 0.980187 0.260051 0.345994 ] [ 0.508396 0.25943 0.848838 ] [ 0.491604 0.75943 0.151162 ] [ 0.673119 0.256094 0.957869 ] [ 0.267205 0.257609 0.88044 ] [ 0.932012 0.947605 0.746831 ] [ 0.939925 0.571717 0.7472 ] [ 0.579234 0.260549 0.712265 ] [ 0.304974 0.767076 0.629571 ] [ 0.870624 0.756081 0.502038 ] [ 0.129376 0.256081 0.497962 ] [ 0.695026 0.267076 0.370429 ] [ 0.420766 0.760549 0.287735 ] [ 0.060075 0.071717 0.2528 ] [ 0.067988 0.447605 0.253169 ] [ 0.732795 0.757609 0.11956 ] [ 0.326881 0.756094 0.042131 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Zn" "Zn" "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" 5.31185925 "source-unit" "angstrom" } "b" { "source-value" 6.60227773 "source-unit" "angstrom" } "c" { "source-value" 8.99473981 "source-unit" "angstrom" } "beta" { "source-value" 90.94659431 "source-unit" "degree" } }