{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Immm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0 0.5 0.818925 ] [ 0 0.5 0.181075 ] [ 0.5 0 0.318925 ] [ 0.5 0 0.681075 ] [ 0 0 0.77391 ] [ 0.5 0.253548 0.108022 ] [ 0.5 0.746452 0.891978 ] [ 0 0 0.22609 ] [ 0.5 0.746452 0.108022 ] [ 0.5 0.253548 0.891978 ] [ 0.5 0.5 0.27391 ] [ 0 0.753548 0.608022 ] [ 0 0.246452 0.391978 ] [ 0.5 0.5 0.72609 ] [ 0 0.246452 0.608022 ] [ 0 0.753548 0.391978 ] ] } "species" { "source-value" [ "K" "K" "U" "U" "U" "U" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.05302601015 "source-unit" "angstrom" } "b" { "source-value" 5.53577611224 "source-unit" "angstrom" } "c" { "source-value" 22.1039586626 "source-unit" "angstrom" } }