{ "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" [ [ 0.17763 0.327529 0.07348 ] [ 0.784128 0.974279 0.237784 ] [ 0.797631 0.419201 0.301838 ] [ 0.202369 0.580799 0.698162 ] [ 0.215872 0.025721 0.762216 ] [ 0.82237 0.672471 0.92652 ] [ 0.219273 0.728885 0.350355 ] [ 0.780727 0.271115 0.649645 ] [ 0.308614 0.235357 0.416122 ] [ 0.691386 0.764643 0.583878 ] [ 0.716446 0.255267 0.974306 ] [ 0.283554 0.744733 0.025694 ] [ 0.09317 0.682659 0.113544 ] [ 0.526457 0.761662 0.073705 ] [ 0.792705 0.219599 0.110458 ] [ 0.183301 0.032245 0.330656 ] [ 0.22832 0.407868 0.319813 ] [ 0.620705 0.220442 0.420752 ] [ 0.792134 0.710843 0.412946 ] [ 0.207866 0.289157 0.587054 ] [ 0.379295 0.779558 0.579248 ] [ 0.816699 0.967755 0.669344 ] [ 0.77168 0.592132 0.680187 ] [ 0.207295 0.780401 0.889542 ] [ 0.473543 0.238338 0.926295 ] [ 0.90683 0.317341 0.886456 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Fe" "Fe" "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" 4.98070758 "source-unit" "angstrom" } "b" { "source-value" 6.5291364 "source-unit" "angstrom" } "c" { "source-value" 8.71621326 "source-unit" "angstrom" } "alpha" { "source-value" 99.38080862 "source-unit" "degree" } "beta" { "source-value" 90.15290634 "source-unit" "degree" } "gamma" { "source-value" 90.3444635 "source-unit" "degree" } }