{ "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 0.836496 0.25 ] [ 0 0.163504 0.75 ] [ 0.5 0.336496 0.25 ] [ 0.5 0.663504 0.75 ] [ 0.5 0.070192 0.25 ] [ 0.5 0.929808 0.75 ] [ 0 0.570192 0.25 ] [ 0 0.429808 0.75 ] ] } "species" { "source-value" [ "Hf" "Hf" "Hf" "Hf" "Al" "Al" "Al" "Al" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.25251214305 "source-unit" "angstrom" } "b" { "source-value" 10.8865414894 "source-unit" "angstrom" } "c" { "source-value" 4.30016381 "source-unit" "angstrom" } }