{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.888418 0.601676 0.669779 ] [ 0.611582 0.101676 0.830221 ] [ 0.111582 0.398324 0.330221 ] [ 0.388418 0.898324 0.169779 ] [ 0.209101 0.333944 0.965561 ] [ 0.290899 0.833944 0.534439 ] [ 0.790899 0.666056 0.034439 ] [ 0.709101 0.166056 0.465561 ] [ 0.035748 0.101271 0.713208 ] [ 0.464252 0.601271 0.786792 ] [ 0.964252 0.898729 0.286792 ] [ 0.535748 0.398729 0.213208 ] [ 0.197477 0.834414 0.876446 ] [ 0.302523 0.334414 0.623554 ] [ 0.802523 0.165586 0.123554 ] [ 0.697477 0.665586 0.376446 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "K" "K" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.30612696052 "source-unit" "angstrom" } "b" { "source-value" 7.08454063 "source-unit" "angstrom" } "c" { "source-value" 12.4154339838 "source-unit" "angstrom" } "beta" { "source-value" 97.1733367856 "source-unit" "degree" } }