{ "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" [ [ 0.348557 0.339156 0.924456 ] [ 0.944178 0.617757 0.844195 ] [ 0.381184 0.820944 0.805773 ] [ 0.618816 0.320944 0.694227 ] [ 0.055822 0.117757 0.655805 ] [ 0.651443 0.839156 0.575544 ] [ 0.348557 0.160844 0.424456 ] [ 0.944178 0.882243 0.344195 ] [ 0.381184 0.679056 0.305773 ] [ 0.618816 0.179056 0.194227 ] [ 0.055822 0.382243 0.155805 ] [ 0.651443 0.660844 0.075544 ] [ 0.842095 0.085522 0.932301 ] [ 0.157905 0.585522 0.567699 ] [ 0.842095 0.414478 0.432301 ] [ 0.157905 0.914478 0.067699 ] [ 0.753884 0.344841 0.956155 ] [ 0.101329 0.056192 0.910981 ] [ 0.701099 0.943719 0.807726 ] [ 0.298901 0.443719 0.692274 ] [ 0.898671 0.556192 0.589019 ] [ 0.246116 0.844841 0.543845 ] [ 0.753884 0.155159 0.456155 ] [ 0.101329 0.443808 0.410981 ] [ 0.701099 0.556281 0.307726 ] [ 0.298901 0.056281 0.192274 ] [ 0.898671 0.943808 0.089019 ] [ 0.246116 0.655159 0.043845 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Y" "Y" "Y" "Y" "O" "O" "O" "O" "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" 8.39358056 "source-unit" "angstrom" } "b" { "source-value" 7.63534261 "source-unit" "angstrom" } "c" { "source-value" 12.23763685 "source-unit" "angstrom" } "beta" { "source-value" 95.48184086 "source-unit" "degree" } }