{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.116299 0.56329 0.01586 ] [ 0.065019 0.465146 0.526017 ] [ 0.675056 0.89366 0.871038 ] [ 0.705251 0.883462 0.367668 ] [ 0.279798 0.106847 0.623978 ] [ 0.325003 0.123985 0.129478 ] [ 0.86382 0.905073 0.633042 ] [ 0.507286 0.891153 0.130525 ] [ 0.454237 0.090504 0.859885 ] [ 0.117977 0.114075 0.366834 ] [ 0.635496 0.501652 0.243722 ] [ 0.294303 0.75091 0.451424 ] [ 0.937909 0.754965 0.962344 ] [ 0.041948 0.246642 0.0404 ] [ 0.677725 0.243117 0.531413 ] [ 0.325826 0.500257 0.751013 ] ] } "species" { "source-value" [ "Li" "Li" "Fe" "Fe" "Fe" "Fe" "O" "O" "O" "O" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.11498454 "source-unit" "angstrom" } "b" { "source-value" 5.93668275 "source-unit" "angstrom" } "c" { "source-value" 7.10631883 "source-unit" "angstrom" } "alpha" { "source-value" 108.95949524 "source-unit" "degree" } "beta" { "source-value" 89.61354092 "source-unit" "degree" } "gamma" { "source-value" 115.25670567 "source-unit" "degree" } }