{ "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" [ [ 0.703089 0.28175 0.693772 ] [ 0.296911 0.71825 0.306228 ] [ 0 0 0 ] [ 0.371287 0.683606 0.785774 ] [ 0.628713 0.316394 0.214226 ] [ 0.385926 0.864788 0.649641 ] [ 0.614074 0.135212 0.350359 ] [ 0.231322 0.779935 0.988843 ] [ 0.768678 0.220065 0.011157 ] [ 0.315202 0.309 0.160256 ] [ 0.198253 0.39928 0.676769 ] [ 0.801747 0.60072 0.323231 ] [ 0.684798 0.691 0.839744 ] ] } "species" { "source-value" [ "Cd" "Cd" "Cu" "P" "P" "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" 4.87300469429 "source-unit" "angstrom" } "b" { "source-value" 5.71340508005 "source-unit" "angstrom" } "c" { "source-value" 6.86984904495 "source-unit" "angstrom" } "alpha" { "source-value" 105.75911896 "source-unit" "degree" } "beta" { "source-value" 87.0833374488 "source-unit" "degree" } "gamma" { "source-value" 110.173974384 "source-unit" "degree" } }