{ "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" [ [ 0.213491 0.831635 0.467251 ] [ 0.286509 0.331635 0.032749 ] [ 0.786509 0.168365 0.532749 ] [ 0.713491 0.668365 0.967251 ] [ 0.617488 0.598605 0.331226 ] [ 0.882512 0.098605 0.168774 ] [ 0.382512 0.401395 0.668774 ] [ 0.117488 0.901395 0.831226 ] [ 0.296029 0.831034 0.129889 ] [ 0.203971 0.331034 0.370111 ] [ 0.703971 0.168966 0.870111 ] [ 0.796029 0.668966 0.629889 ] [ 0.454641 0.095957 0.283915 ] [ 0.045359 0.595957 0.216085 ] [ 0.545359 0.904043 0.716085 ] [ 0.954641 0.404043 0.783915 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "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" 7.54166174969 "source-unit" "angstrom" } "b" { "source-value" 7.32044328 "source-unit" "angstrom" } "c" { "source-value" 12.9478353989 "source-unit" "angstrom" } "beta" { "source-value" 97.9480999934 "source-unit" "degree" } }