{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.220216 0.274191 0.427312 ] [ 0.220216 0.725809 0.427312 ] [ 0.720216 0.774191 0.427312 ] [ 0.720216 0.225809 0.427312 ] [ 0.085045 0.743673 0.87036 ] [ 0.085045 0.256327 0.87036 ] [ 0.039691 0 0.535739 ] [ 0.447809 0 0.523364 ] [ 0.585045 0.243673 0.87036 ] [ 0.585045 0.756327 0.87036 ] [ 0.539691 0.5 0.535739 ] [ 0.947809 0.5 0.523364 ] [ 0.872988 0 0.988891 ] [ 0.35999 0 0.992663 ] [ 0.372988 0.5 0.988891 ] [ 0.85999 0.5 0.992663 ] ] } "species" { "source-value" [ "Bi" "Bi" "Bi" "Bi" "Pd" "Pd" "Pd" "Pd" "Pd" "Pd" "Pd" "Pd" "Pb" "Pb" "Pb" "Pb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.331979451 "source-unit" "angstrom" } "b" { "source-value" 8.85295502009 "source-unit" "angstrom" } "c" { "source-value" 5.6688205975 "source-unit" "angstrom" } "beta" { "source-value" 108.535747902 "source-unit" "degree" } }