{ "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 0 0.981463 ] [ 0.666667 0.333333 0.314797 ] [ 0.333333 0.666667 0.64813 ] [ 0 0 0.489136 ] [ 0.666667 0.333333 0.82247 ] [ 0.333333 0.666667 0.155803 ] [ 0.277406 0.138703 0.551455 ] [ 0.944073 0.472036 0.884788 ] [ 0.610739 0.80537 0.218121 ] [ 0.861297 0.722594 0.551455 ] [ 0.527964 0.055927 0.884788 ] [ 0.19463 0.389261 0.218121 ] [ 0.861297 0.138703 0.551455 ] [ 0.527964 0.472036 0.884788 ] [ 0.19463 0.80537 0.218121 ] ] } "species" { "source-value" [ "K" "K" "K" "Cl" "Cl" "Cl" "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" 5.82394454959 "source-unit" "angstrom" } "alpha" { "source-value" 90 "source-unit" "degree" } }