{ "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 0.5 0.5 ] [ 0 0 0 ] [ 0.23686 0.793849 0.795799 ] [ 0.76314 0.293849 0.704201 ] [ 0.23686 0.706151 0.295799 ] [ 0.76314 0.206151 0.204201 ] ] } "species" { "source-value" [ "Ag" "Ag" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.71136892 "source-unit" "angstrom" } "b" { "source-value" 5.12801811 "source-unit" "angstrom" } "c" { "source-value" 5.98009095 "source-unit" "angstrom" } "beta" { "source-value" 122.76911959 "source-unit" "degree" } }