{ "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" [ [ 0.506841 0.087643 0.311709 ] [ 0.497751 0.090223 0.763889 ] [ 0.992195 0.537309 0.747788 ] [ 0.002015 0.557337 0.307994 ] [ 0.500555 0.516494 0.502447 ] [ 0.999249 0.0028 0.005198 ] [ 0.001204 0.001318 0.501685 ] [ 0.499243 0.504047 0.000664 ] [ 0.64897 0.177891 0.066902 ] [ 0.30343 0.180633 0.550891 ] [ 0.803433 0.290861 0.436563 ] [ 0.199448 0.323925 0.912277 ] [ 0.370746 0.492423 0.235913 ] [ 0.624013 0.469891 0.761958 ] [ 0.822434 0.652409 0.06713 ] [ 0.177858 0.688814 0.548442 ] [ 0.712748 0.805964 0.429564 ] [ 0.331801 0.807985 0.916264 ] [ 0.146909 0.983414 0.261616 ] [ 0.859155 0.971016 0.742303 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Fe" "Bi" "Te" "Te" "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" 5.24111046 "source-unit" "angstrom" } "b" { "source-value" 5.49953369 "source-unit" "angstrom" } "c" { "source-value" 7.62376113 "source-unit" "angstrom" } "alpha" { "source-value" 86.09602777 "source-unit" "degree" } "beta" { "source-value" 89.98108689 "source-unit" "degree" } "gamma" { "source-value" 89.78932888 "source-unit" "degree" } }