{ "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" [ [ 0.035943 0.210067 0.008708 ] [ 0.535943 0.289933 0.008708 ] [ 0.249392 0.057861 0.761667 ] [ 0.209165 0.780774 0.536122 ] [ 0.749392 0.442139 0.761667 ] [ 0.290835 0.280774 0.463878 ] [ 0.709165 0.719226 0.536122 ] [ 0.250608 0.557861 0.238333 ] [ 0.790835 0.219226 0.463878 ] [ 0.750608 0.942139 0.238333 ] [ 0.464057 0.710067 0.991292 ] [ 0.964057 0.789933 0.991292 ] [ 0.182128 0.48665 0.729547 ] [ 0.682128 0.01335 0.729547 ] [ 0.317872 0.98665 0.270453 ] [ 0.817872 0.51335 0.270453 ] [ 0.046326 0.609715 0.827354 ] [ 0.138922 0.304034 0.739445 ] [ 0.546326 0.890285 0.827354 ] [ 0.399681 0.554257 0.664843 ] [ 0.638922 0.195966 0.739445 ] [ 0.100319 0.054257 0.335157 ] [ 0.899681 0.945743 0.664843 ] [ 0.361078 0.804034 0.260555 ] [ 0.600319 0.445743 0.335157 ] [ 0.453674 0.109715 0.172646 ] [ 0.861078 0.695966 0.260555 ] [ 0.953674 0.390285 0.172646 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Co" "Co" "Co" "Co" "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" 6.4437994 "source-unit" "angstrom" } "b" { "source-value" 9.63011726 "source-unit" "angstrom" } "c" { "source-value" 6.89606517 "source-unit" "angstrom" } "beta" { "source-value" 116.15701456 "source-unit" "degree" } }