{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.820252 0.676695 0.827053 ] [ 0 0 0.5 ] [ 0.33831 0.68557 0.817238 ] [ 0.66169 0.31443 0.182762 ] [ 0.179748 0.323306 0.172947 ] [ 0.08056 0.168621 0.833774 ] [ 0.580141 0.168154 0.833011 ] [ 0.748332 0.502874 0.501457 ] [ 0.91944 0.831379 0.166226 ] [ 0.251668 0.497126 0.498543 ] [ 0.419859 0.831846 0.166989 ] [ 0.709929 0.395668 0.804213 ] [ 0.904406 0.715477 0.468527 ] [ 0.604594 0.283964 0.531781 ] [ 0.209545 0.396787 0.801071 ] [ 0.049793 0.056888 0.138618 ] [ 0.790455 0.603213 0.198929 ] [ 0.395406 0.716036 0.468219 ] [ 0.095594 0.284523 0.531473 ] [ 0.950207 0.943112 0.861382 ] [ 0.554302 0.054121 0.133274 ] [ 0.290071 0.604332 0.195787 ] [ 0.445698 0.945879 0.866726 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Ni" "Ni" "Ni" "Ni" "Ni" "Ni" "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" 5.98443077 "source-unit" "angstrom" } "b" { "source-value" 6.85380105 "source-unit" "angstrom" } "c" { "source-value" 6.90597896 "source-unit" "angstrom" } "alpha" { "source-value" 66.80694689 "source-unit" "degree" } "beta" { "source-value" 76.8409346 "source-unit" "degree" } "gamma" { "source-value" 67.21001774 "source-unit" "degree" } }