{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/mnm" } "basis-atom-coordinates" { "source-value" [ [ 0.155094 0.155094 0.263634 ] [ 0.344906 0.655094 0.763634 ] [ 0.844906 0.844906 0.736366 ] [ 0.844906 0.844906 0.263634 ] [ 0.155094 0.155094 0.736366 ] [ 0 0.5 0 ] [ 0.344906 0.655094 0.236366 ] [ 0.5 0 0.5 ] [ 0.655094 0.344906 0.763634 ] [ 0.655094 0.344906 0.236366 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.158267 0.841733 0.5 ] [ 0.341733 0.341733 0 ] [ 0.658267 0.658267 0 ] [ 0.841733 0.158267 0.5 ] ] } "species" { "source-value" [ "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ru" "Ru" "Ru" "Ru" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.57856955 "source-unit" "angstrom" } "c" { "source-value" 6.78135379 "source-unit" "angstrom" } }