{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.04171 0.316505 0.018471 ] [ 0.95829 0.816505 0.481529 ] [ 0.04171 0.183495 0.518471 ] [ 0.95829 0.683495 0.981529 ] [ 0.296113 0.988258 0.187808 ] [ 0.703887 0.488258 0.312192 ] [ 0.296113 0.511742 0.687808 ] [ 0.703887 0.011742 0.812192 ] [ 0.182311 0.574269 0.18903 ] [ 0.619563 0.154825 0.642195 ] [ 0.836225 0.617101 0.516073 ] [ 0.163775 0.117101 0.983927 ] [ 0.817689 0.074269 0.31097 ] [ 0.619563 0.345175 0.142195 ] [ 0.380437 0.654825 0.857805 ] [ 0.182311 0.925731 0.68903 ] [ 0.836225 0.882899 0.016073 ] [ 0.163775 0.382899 0.483927 ] [ 0.380437 0.845175 0.357805 ] [ 0.817689 0.425731 0.81097 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.27909635 "source-unit" "angstrom" } "b" { "source-value" 9.81222043 "source-unit" "angstrom" } "c" { "source-value" 7.74363309 "source-unit" "angstrom" } "beta" { "source-value" 106.30093698 "source-unit" "degree" } }