{ "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" [ [ 0.421161 0.865439 0.114927 ] [ 0.499863 0.001845 0.502342 ] [ 0.987784 0.491272 0.995839 ] [ 0.12209 0.256841 0.655973 ] [ 0.360875 0.231459 0.147966 ] [ 0.630247 0.768503 0.850207 ] [ 0.877132 0.737577 0.338633 ] [ 0.002217 0.001757 0.004609 ] [ 0.441385 0.506647 0.630144 ] [ 0.537148 0.503149 0.405046 ] [ 0.113926 0.832749 0.452968 ] [ 0.987158 0.699809 0.170674 ] [ 0.155801 0.355459 0.171531 ] [ 0.272192 0.442868 0.570073 ] [ 0.369827 0.669552 0.948095 ] [ 0.550888 0.81308 0.673735 ] [ 0.225291 0.051136 0.057983 ] [ 0.332044 0.136292 0.675255 ] [ 0.653833 0.852628 0.319025 ] [ 0.756446 0.936792 0.954219 ] [ 0.453784 0.182366 0.320092 ] [ 0.605021 0.337825 0.04827 ] [ 0.739729 0.550762 0.419747 ] [ 0.819494 0.633844 0.825653 ] [ 0.030655 0.300505 0.824847 ] [ 0.884237 0.171272 0.537596 ] ] } "species" { "source-value" [ "Li" "Sn" "Sn" "P" "P" "P" "P" "H" "H" "H" "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" 4.96316177 "source-unit" "angstrom" } "b" { "source-value" 7.57202436 "source-unit" "angstrom" } "c" { "source-value" 8.17948581 "source-unit" "angstrom" } "alpha" { "source-value" 89.9787167 "source-unit" "degree" } "beta" { "source-value" 91.23927548 "source-unit" "degree" } "gamma" { "source-value" 103.9677984 "source-unit" "degree" } }