{ "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" [ [ 0.28422 0.881081 0.484204 ] [ 0.78422 0.618919 0.984204 ] [ 0.71578 0.118919 0.515796 ] [ 0.21578 0.381081 0.015796 ] [ 0.203125 0.330652 0.507933 ] [ 0.296875 0.830652 0.992067 ] [ 0.703125 0.169348 0.007933 ] [ 0.796875 0.669348 0.492067 ] [ 0.699825 0.40116 0.279843 ] [ 0.800175 0.90116 0.220157 ] [ 0.300175 0.59884 0.720157 ] [ 0.199825 0.09884 0.779843 ] [ 0.250689 0.9482 0.785778 ] [ 0.086205 0.869852 0.202178 ] [ 0.217596 0.644144 0.912069 ] [ 0.750689 0.5518 0.285778 ] [ 0.652861 0.826988 0.071746 ] [ 0.586205 0.630148 0.702178 ] [ 0.347139 0.173012 0.928254 ] [ 0.717596 0.855856 0.412069 ] [ 0.413795 0.369852 0.297822 ] [ 0.847139 0.326988 0.428254 ] [ 0.913795 0.130148 0.797822 ] [ 0.749311 0.0518 0.214222 ] [ 0.249311 0.4482 0.714222 ] [ 0.782404 0.355856 0.087931 ] [ 0.152861 0.673012 0.571746 ] [ 0.282404 0.144144 0.587931 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Co" "Co" "Co" "Co" "P" "P" "P" "P" "O" "O" "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" 5.29741846972 "source-unit" "angstrom" } "b" { "source-value" 10.13521097 "source-unit" "angstrom" } "c" { "source-value" 7.47522284746 "source-unit" "angstrom" } "beta" { "source-value" 90.2263117831 "source-unit" "degree" } }