{ "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 0.491529 ] [ 0.666667 0.333333 0.824862 ] [ 0.333333 0.666667 0.158195 ] [ 0 0 0.001356 ] [ 0.666667 0.333333 0.33469 ] [ 0.333333 0.666667 0.668023 ] [ 0.188062 0.376124 0.771805 ] [ 0.854729 0.709458 0.105138 ] [ 0.521396 0.042791 0.438472 ] [ 0.188062 0.811938 0.771805 ] [ 0.854729 0.145271 0.105138 ] [ 0.521396 0.478604 0.438472 ] [ 0.623876 0.811938 0.771805 ] [ 0.290542 0.145271 0.105138 ] [ 0.957209 0.478604 0.438472 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "I" "I" "I" "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" 6.47539760379 "source-unit" "angstrom" } "alpha" { "source-value" 90 "source-unit" "degree" } }