{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0 0.057873 0 ] [ 0.5 0.557873 0 ] [ 0 0.712752 0.5 ] [ 0.5 0.212752 0.5 ] [ 0.241805 0.759736 0.950615 ] [ 0.149622 0.98973 0.34825 ] [ 0.850378 0.98973 0.65175 ] [ 0.758195 0.759736 0.049385 ] [ 0.741805 0.259736 0.950615 ] [ 0.649622 0.48973 0.34825 ] [ 0.350378 0.48973 0.65175 ] [ 0.258195 0.259736 0.049385 ] ] } "species" { "source-value" [ "Nb" "Nb" "Bi" "Bi" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.98961266 "source-unit" "angstrom" } "b" { "source-value" 5.88203456 "source-unit" "angstrom" } "c" { "source-value" 6.05526188 "source-unit" "angstrom" } "beta" { "source-value" 112.943974 "source-unit" "degree" } }