{ "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 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0 0 0.5 ] [ 0.5 0 0 ] [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.710929 0.21113 0.447752 ] [ 0.263964 0.770394 0.990058 ] [ 0.259499 0.218566 0.474723 ] [ 0.730392 0.773122 0.996131 ] [ 0.269608 0.226878 0.003869 ] [ 0.740501 0.781434 0.525277 ] [ 0.736036 0.229606 0.009942 ] [ 0.289072 0.78887 0.552248 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Fe" "Fe" "Ni" "Ni" "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" 5.85475747 "source-unit" "angstrom" } "b" { "source-value" 5.87750827 "source-unit" "angstrom" } "c" { "source-value" 5.89209841 "source-unit" "angstrom" } "alpha" { "source-value" 119.15729307 "source-unit" "degree" } "beta" { "source-value" 119.64422274 "source-unit" "degree" } "gamma" { "source-value" 90.14574218 "source-unit" "degree" } }