{ "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" [ [ 0.782415 0.811684 0.420994 ] [ 0.217585 0.188316 0.579006 ] [ 0.026959 0.252772 0.076765 ] [ 0.973041 0.747228 0.923235 ] [ 0.623002 0.280975 0.804458 ] [ 0.376998 0.719025 0.195542 ] [ 0.532809 0.712401 0.832028 ] [ 0.262735 0.668151 0.576754 ] [ 0.467191 0.287599 0.167972 ] [ 0.737265 0.331849 0.423246 ] [ 0.724495 0.581414 0.22266 ] [ 0.76085 0.090966 0.635289 ] [ 0.292993 0.914182 0.939019 ] [ 0.216112 0.501717 0.254166 ] [ 0.275505 0.418586 0.77734 ] [ 0.707007 0.085818 0.060981 ] [ 0.23915 0.909034 0.364711 ] [ 0.783888 0.498283 0.745834 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Sn" "Sn" "Au" "Au" "Au" "Au" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.50744181568 "source-unit" "angstrom" } "b" { "source-value" 8.46754309633 "source-unit" "angstrom" } "c" { "source-value" 9.35513351298 "source-unit" "angstrom" } "alpha" { "source-value" 71.6242556656 "source-unit" "degree" } "beta" { "source-value" 82.0922614245 "source-unit" "degree" } "gamma" { "source-value" 67.751480152 "source-unit" "degree" } }