{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1nb" } "basis-atom-coordinates" { "source-value" [ [ 0.707075 0.020327 0.175767 ] [ 0.792925 0.020327 0.675767 ] [ 0.207075 0.520327 0.324233 ] [ 0.292925 0.520327 0.824233 ] [ 0.821087 0.247858 0.420681 ] [ 0.678913 0.247858 0.920681 ] [ 0.321087 0.747858 0.079319 ] [ 0.178913 0.747858 0.579319 ] [ 0.203194 0.247397 0.068105 ] [ 0.296806 0.247397 0.568105 ] [ 0.703194 0.747397 0.431895 ] [ 0.796806 0.747397 0.931895 ] [ 0.330867 0.049226 0.135405 ] [ 0.169133 0.049226 0.635405 ] [ 0.913228 0.218133 0.067367 ] [ 0.586772 0.218133 0.567367 ] [ 0.199194 0.26252 0.430804 ] [ 0.300806 0.26252 0.930804 ] [ 0.278022 0.454436 0.145905 ] [ 0.221978 0.454436 0.645905 ] [ 0.830867 0.549226 0.364595 ] [ 0.669133 0.549226 0.864595 ] [ 0.413228 0.718133 0.432633 ] [ 0.086772 0.718133 0.932633 ] [ 0.699194 0.76252 0.069196 ] [ 0.800806 0.76252 0.569196 ] [ 0.778022 0.954436 0.354095 ] [ 0.721978 0.954436 0.854095 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "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" 5.2988747 "source-unit" "angstrom" } "b" { "source-value" 6.11425267 "source-unit" "angstrom" } "c" { "source-value" 10.63347109 "source-unit" "angstrom" } }