{ "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" [ [ 0.382146 0.25104 0.051897 ] [ 0.222918 0.686101 0.571218 ] [ 0.777082 0.313899 0.428782 ] [ 0.617854 0.74896 0.948103 ] [ 0.238263 0.286252 0.429019 ] [ 0.761737 0.713748 0.570981 ] [ 0.242387 0.948101 0.184272 ] [ 0.396948 0.650044 0.259111 ] [ 0.806965 0.611562 0.238449 ] [ 0.902349 0.279055 0.146246 ] [ 0.097651 0.720945 0.853754 ] [ 0.193035 0.388438 0.761551 ] [ 0.603052 0.349956 0.740889 ] [ 0.757613 0.051899 0.815728 ] [ 0.213198 0.92305 0.005007 ] [ 0.147644 0.457834 0.143694 ] [ 0.416818 0.871113 0.251533 ] [ 0.572771 0.621298 0.177154 ] [ 0.99215 0.797049 0.194137 ] [ 0.732924 0.380741 0.126599 ] [ 0.448328 0.645943 0.427657 ] [ 0.340978 0.19001 0.257874 ] [ 0.075555 0.781197 0.704658 ] [ 0.118104 0.381324 0.591512 ] [ 0.881896 0.618676 0.408488 ] [ 0.924445 0.218803 0.295342 ] [ 0.659022 0.80999 0.742126 ] [ 0.551672 0.354057 0.572343 ] [ 0.267076 0.619259 0.873401 ] [ 0.00785 0.202951 0.805863 ] [ 0.427229 0.378702 0.822846 ] [ 0.583182 0.128887 0.748467 ] [ 0.852356 0.542166 0.856306 ] [ 0.786802 0.07695 0.994993 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cr" "Cr" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "O" "O" "O" "O" "O" "O" "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" 6.93969129 "source-unit" "angstrom" } "b" { "source-value" 7.61031792 "source-unit" "angstrom" } "c" { "source-value" 9.70641696 "source-unit" "angstrom" } "alpha" { "source-value" 100.53401152 "source-unit" "degree" } "beta" { "source-value" 102.08096693 "source-unit" "degree" } "gamma" { "source-value" 116.6164447 "source-unit" "degree" } }