{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.694737 0.445749 0.507553 ] [ 0.305263 0.945749 0.492447 ] [ 0.814607 0.736892 0.98197 ] [ 0.185393 0.236892 0.01803 ] [ 0.795652 0.93274 0.698085 ] [ 0.306401 0.649071 0.17135 ] [ 0.693599 0.149071 0.82865 ] [ 0.204348 0.43274 0.301915 ] [ 0.950045 0.359137 0.192561 ] [ 0.673084 0.035274 0.018327 ] [ 0.40805 0.249315 0.269116 ] [ 0.326916 0.535274 0.981673 ] [ 0.093132 0.836273 0.170103 ] [ 0.906868 0.336273 0.829897 ] [ 0.59195 0.749315 0.730884 ] [ 0.049955 0.859137 0.807439 ] [ 0.174126 0.513717 0.488359 ] [ 0.566702 0.734983 0.247226 ] [ 0.825874 0.013717 0.511641 ] [ 0.433298 0.234983 0.752774 ] ] } "species" { "source-value" [ "K" "K" "Sb" "Sb" "P" "P" "P" "P" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.76063379618 "source-unit" "angstrom" } "b" { "source-value" 7.87765186 "source-unit" "angstrom" } "c" { "source-value" 9.90608394741 "source-unit" "angstrom" } "beta" { "source-value" 92.3924445692 "source-unit" "degree" } }