{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_13" } "basis-atom-coordinates" { "source-value" [ [ 0.959164 0.959164 0.959164 ] [ 0.540836 0.040836 0.459164 ] [ 0.459164 0.540836 0.040836 ] [ 0.040836 0.459164 0.540836 ] [ 0.069818 0.069818 0.069818 ] [ 0.430182 0.930182 0.569818 ] [ 0.569818 0.430182 0.930182 ] [ 0.930182 0.569818 0.430182 ] ] } "species" { "source-value" [ "C" "C" "C" "C" "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" 5.96380833 "source-unit" "angstrom" } }