{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.882591 0.25 ] [ 0 0.117409 0.75 ] [ 0.5 0.382591 0.25 ] [ 0.5 0.617409 0.75 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0 0.076251 0.25 ] [ 0 0.923749 0.75 ] [ 0.5 0.188524 0.052735 ] [ 0.5 0.811476 0.947265 ] [ 0.5 0.811476 0.552735 ] [ 0.5 0.188524 0.447265 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0.576251 0.25 ] [ 0.5 0.423749 0.75 ] [ 0 0.688524 0.052735 ] [ 0 0.311476 0.947265 ] [ 0 0.311476 0.552735 ] [ 0 0.688524 0.447265 ] [ 0 0.226432 0.25 ] [ 0 0.773568 0.75 ] [ 0.5 0.726432 0.25 ] [ 0.5 0.273568 0.75 ] ] } "species" { "source-value" [ "Dy" "Dy" "Dy" "Dy" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Ni" "Ni" "Ni" "Ni" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.05864456092 "source-unit" "angstrom" } "b" { "source-value" 15.4161338285 "source-unit" "angstrom" } "c" { "source-value" 6.61447843 "source-unit" "angstrom" } }