{ "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" [ [ 0.760292 0.537643 0.265155 ] [ 0.246588 0.485778 0.746727 ] [ 0.244234 0.018059 0.747849 ] [ 0.201583 0.244713 0.330043 ] [ 0.790638 0.749705 0.663783 ] [ 0.276894 0.746807 0.41966 ] [ 0.729244 0.253241 0.577529 ] [ 0.282533 0.256551 0.046604 ] [ 0.709721 0.744263 0.949055 ] [ 0.046344 0.244623 0.098497 ] [ 0.664508 0.723463 0.090597 ] [ 0.468104 0.266 0.165254 ] [ 0.204586 0.938808 0.3239 ] [ 0.168321 0.560615 0.317244 ] [ 0.844749 0.265603 0.411238 ] [ 0.582786 0.720893 0.456622 ] [ 0.418924 0.25411 0.549941 ] [ 0.157478 0.749871 0.588845 ] [ 0.827493 0.061922 0.672003 ] [ 0.827378 0.437543 0.687213 ] [ 0.519024 0.753319 0.828119 ] [ 0.328924 0.256461 0.899774 ] [ 0.945556 0.756192 0.891408 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Mn" "Mn" "P" "P" "C" "C" "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" 5.06316065 "source-unit" "angstrom" } "b" { "source-value" 6.47587453 "source-unit" "angstrom" } "c" { "source-value" 8.31497629 "source-unit" "angstrom" } "alpha" { "source-value" 90.92690252 "source-unit" "degree" } "beta" { "source-value" 94.12750356 "source-unit" "degree" } "gamma" { "source-value" 90.20232198 "source-unit" "degree" } }