{ "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" [ [ 0.835963 0.820446 0.25 ] [ 0.164037 0.179554 0.75 ] [ 0.835963 0.179554 0.25 ] [ 0.164037 0.820446 0.75 ] [ 0.335963 0.320446 0.25 ] [ 0.664037 0.679554 0.75 ] [ 0.335963 0.679554 0.25 ] [ 0.664037 0.320446 0.75 ] [ 0.798126 0 0.75 ] [ 0.201874 0 0.25 ] [ 0.298126 0.5 0.75 ] [ 0.701874 0.5 0.25 ] [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "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" 7.59498386 "source-unit" "angstrom" } "b" { "source-value" 9.39173123 "source-unit" "angstrom" } "c" { "source-value" 5.92943061 "source-unit" "angstrom" } }