{ "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" [ [ 0.047113 0.25 0.412942 ] [ 0.952887 0.75 0.587058 ] [ 0.809003 0.75 0.065747 ] [ 0.190997 0.25 0.934253 ] [ 0.532653 0.25 0.343725 ] [ 0.467347 0.75 0.656275 ] [ 0.795912 0.75 0.334497 ] [ 0.95556 0.75 0.849862 ] [ 0.309768 0.75 0.41211 ] [ 0.690232 0.25 0.58789 ] [ 0.204088 0.25 0.665503 ] [ 0.04444 0.25 0.150138 ] [ 0.403361 0.75 0.097938 ] [ 0.596639 0.25 0.902062 ] ] } "species" { "source-value" [ "Ag" "Ag" "Bi" "Bi" "Bi" "Bi" "Se" "Se" "Se" "Se" "Se" "Se" "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" 8.15012277801 "source-unit" "angstrom" } "b" { "source-value" 4.14931526 "source-unit" "angstrom" } "c" { "source-value" 11.3106256306 "source-unit" "angstrom" } "beta" { "source-value" 104.192985503 "source-unit" "degree" } }