{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.941144 0.75 0.59369 ] [ 0.058856 0.25 0.40631 ] [ 0.459176 0.75 0.654106 ] [ 0.540824 0.25 0.345894 ] [ 0.187004 0.25 0.927113 ] [ 0.812996 0.75 0.072887 ] [ 0.959508 0.75 0.854165 ] [ 0.682247 0.25 0.58641 ] [ 0.317753 0.75 0.41359 ] [ 0.040492 0.25 0.145835 ] [ 0.199953 0.25 0.66181 ] [ 0.800047 0.75 0.33819 ] [ 0.404303 0.75 0.102056 ] [ 0.595697 0.25 0.897944 ] ] } "species" { "source-value" [ "Ag" "Ag" "Bi" "Bi" "Bi" "Bi" "S" "S" "S" "S" "S" "S" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.85124214688 "source-unit" "angstrom" } "b" { "source-value" 4.02846261 "source-unit" "angstrom" } "c" { "source-value" 10.9146380016 "source-unit" "angstrom" } "beta" { "source-value" 102.880839756 "source-unit" "degree" } }