{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.759725 0.505406 0.197249 ] [ 0.240275 0.005406 0.802751 ] [ 0.219934 0.238674 0.342503 ] [ 0.780066 0.738674 0.657497 ] [ 0.277596 0.740613 0.419785 ] [ 0.722404 0.240613 0.580215 ] [ 0.273797 0.265025 0.049319 ] [ 0.726203 0.765025 0.950681 ] [ 0.694834 0.717457 0.078438 ] [ 0.046624 0.2708 0.108165 ] [ 0.465221 0.303698 0.148487 ] [ 0.211717 0.921922 0.329515 ] [ 0.144061 0.564361 0.348248 ] [ 0.806595 0.264624 0.419314 ] [ 0.573449 0.709573 0.433189 ] [ 0.426551 0.209573 0.566811 ] [ 0.193405 0.764624 0.580686 ] [ 0.855939 0.064361 0.651752 ] [ 0.788283 0.421922 0.670485 ] [ 0.534779 0.803698 0.851513 ] [ 0.953376 0.7708 0.891835 ] [ 0.305166 0.217457 0.921562 ] ] } "species" { "source-value" [ "Li" "Li" "Ce" "Ce" "P" "P" "C" "C" "O" "O" "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" 5.22660762 "source-unit" "angstrom" } "b" { "source-value" 7.00020184 "source-unit" "angstrom" } "c" { "source-value" 9.14010592 "source-unit" "angstrom" } "beta" { "source-value" 93.43829914 "source-unit" "degree" } }