{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0.835766 0.67106 0.75 ] [ 0.164234 0.67106 0.25 ] [ 0.835766 0.32894 0.75 ] [ 0.164234 0.32894 0.25 ] [ 0.335766 0.17106 0.75 ] [ 0.664234 0.17106 0.25 ] [ 0.335766 0.82894 0.75 ] [ 0.664234 0.82894 0.25 ] [ 0.266599 0 0.25 ] [ 0.733401 0 0.75 ] [ 0.766599 0.5 0.25 ] [ 0.233401 0.5 0.75 ] [ 0 0 0 ] [ 0 0 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0.5 0.5 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "K" "K" "Sb" "Sb" "Sb" "Sb" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.9664858 "source-unit" "angstrom" } "b" { "source-value" 10.61582372 "source-unit" "angstrom" } "c" { "source-value" 6.6385724 "source-unit" "angstrom" } }