{ "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" [ [ 0.650633 0.952878 0.283571 ] [ 0.847879 0.54687 0.219401 ] [ 0.149805 0.454356 0.781359 ] [ 0.349571 0.046758 0.717506 ] [ 0.667668 0.686512 0.917995 ] [ 0.332685 0.314003 0.079467 ] [ 0.165799 0.186782 0.420149 ] [ 0.839481 0.816279 0.581861 ] [ 0.169163 0.833195 0.096333 ] [ 0.330174 0.66546 0.406089 ] [ 0.669704 0.334705 0.595203 ] [ 0.831182 0.165317 0.901569 ] [ 0.909533 0.825274 0.122962 ] [ 0.682117 0.984787 0.806827 ] [ 0.207452 0.837313 0.519351 ] [ 0.589277 0.677751 0.382877 ] [ 0.181902 0.485718 0.310949 ] [ 0.713894 0.338418 0.015511 ] [ 0.286593 0.659082 0.983264 ] [ 0.819728 0.516298 0.686423 ] [ 0.410329 0.326129 0.623112 ] [ 0.785772 0.15898 0.483239 ] [ 0.319008 0.013861 0.188994 ] [ 0.090651 0.173274 0.875989 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Fe" "B" "B" "B" "B" "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" 5.24280627 "source-unit" "angstrom" } "b" { "source-value" 6.05305562 "source-unit" "angstrom" } "c" { "source-value" 8.27949597 "source-unit" "angstrom" } "alpha" { "source-value" 103.43523514 "source-unit" "degree" } "beta" { "source-value" 90.79997006 "source-unit" "degree" } "gamma" { "source-value" 90.73438882 "source-unit" "degree" } }