{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.322721 0.75773 0.404525 ] [ 0.677279 0.24227 0.595475 ] [ 0 0.5 0 ] [ 0.677535 0.878916 0.880838 ] [ 0.322465 0.121084 0.119162 ] [ 0.056312 0.164066 0.891703 ] [ 0.336371 0.761974 0.98139 ] [ 0.059532 0.127315 0.523304 ] [ 0.497971 0.899872 0.665729 ] [ 0.240931 0.450517 0.20811 ] [ 0.759069 0.549483 0.79189 ] [ 0.502029 0.100128 0.334271 ] [ 0.940468 0.872685 0.476696 ] [ 0.663629 0.238026 0.01861 ] [ 0.943688 0.835934 0.108297 ] ] } "species" { "source-value" [ "Li" "Li" "Fe" "Fe" "Fe" "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" 4.92595479 "source-unit" "angstrom" } "b" { "source-value" 5.07782868 "source-unit" "angstrom" } "c" { "source-value" 7.77747856 "source-unit" "angstrom" } "alpha" { "source-value" 98.10229557 "source-unit" "degree" } "beta" { "source-value" 104.15506942 "source-unit" "degree" } "gamma" { "source-value" 104.88224287 "source-unit" "degree" } }