{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-rhombohedral-crystal-npt" "instance-id" 1 "space-group" { "source-value" "R3m" } "basis-atom-coordinates" { "source-value" [ [ 0.333333 0.666667 0.859556 ] [ 0.666667 0.333333 0.026517 ] [ 0 0 0.192889 ] [ 0.333333 0.666667 0.359851 ] [ 0.666667 0.333333 0.526222 ] [ 0 0 0.693184 ] [ 0 0 0.02833 ] [ 0.666667 0.333333 0.915451 ] [ 0.666667 0.333333 0.139813 ] [ 0.666667 0.333333 0.361663 ] [ 0.333333 0.666667 0.248784 ] [ 0.333333 0.666667 0.473146 ] [ 0.333333 0.666667 0.694997 ] [ 0 0 0.582117 ] [ 0 0 0.80648 ] ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" "Al" "Al" "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" 3.0347282 "source-unit" "angstrom" } "alpha" { "source-value" 90 "source-unit" "degree" } }