{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/c" } "basis-atom-coordinates" { "source-value" [ [ 0 0.636637 0.75 ] [ 0 0.363363 0.25 ] [ 0.5 0.136637 0.75 ] [ 0.5 0.863363 0.25 ] [ 0 0.906959 0.25 ] [ 0 0.093041 0.75 ] [ 0.5 0.406959 0.25 ] [ 0.5 0.593041 0.75 ] [ 0.817352 0.94872 0.779711 ] [ 0.182648 0.94872 0.720289 ] [ 0.817352 0.05128 0.279711 ] [ 0.182648 0.05128 0.220289 ] [ 0.317352 0.44872 0.779711 ] [ 0.682648 0.44872 0.720289 ] [ 0.317352 0.55128 0.279711 ] [ 0.682648 0.55128 0.220289 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Sb" "Sb" "Sb" "Sb" "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" 7.97020730676 "source-unit" "angstrom" } "b" { "source-value" 8.67785397623 "source-unit" "angstrom" } "c" { "source-value" 5.67969376028 "source-unit" "angstrom" } "beta" { "source-value" 125.037763877 "source-unit" "degree" } }