{ "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" [ [ 0.498307 0.784878 0.416547 ] [ 0.513706 0.612359 0.773066 ] [ 0 0.5 0.5 ] [ 0.486294 0.387641 0.226934 ] [ 0.501693 0.215122 0.583453 ] [ 0.005177 0.901807 0.691096 ] [ 0.994823 0.098193 0.308904 ] [ 0.002851 0.311784 0.887693 ] [ 0.997149 0.688216 0.112307 ] [ 0.5 0 0 ] [ 0.238497 0.950579 0.860365 ] [ 0.769891 0.864534 0.545373 ] [ 0.766749 0.66417 0.942927 ] [ 0.24937 0.769151 0.231953 ] [ 0.231228 0.548981 0.664441 ] [ 0.768772 0.451019 0.335559 ] [ 0.75063 0.230849 0.768047 ] [ 0.233251 0.33583 0.057073 ] [ 0.230109 0.135466 0.454627 ] [ 0.761503 0.049421 0.139635 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Cr" "Cr" "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" 5.1320806 "source-unit" "angstrom" } "b" { "source-value" 5.14008911 "source-unit" "angstrom" } "c" { "source-value" 7.90888349 "source-unit" "angstrom" } "alpha" { "source-value" 71.51984899 "source-unit" "degree" } "beta" { "source-value" 71.39325461 "source-unit" "degree" } "gamma" { "source-value" 80.13784167 "source-unit" "degree" } }