{ "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" [ [ 0.281656 0 0.75 ] [ 0.718344 0 0.25 ] [ 0.781656 0.5 0.75 ] [ 0.218344 0.5 0.25 ] [ 0.778879 0.838566 0.75 ] [ 0.778879 0.161434 0.75 ] [ 0.221121 0.161434 0.25 ] [ 0.221121 0.838566 0.25 ] [ 0.278879 0.338566 0.75 ] [ 0.278879 0.661434 0.75 ] [ 0.721121 0.661434 0.25 ] [ 0.721121 0.338566 0.25 ] ] } "species" { "source-value" [ "V" "V" "V" "V" "Au" "Au" "Au" "Au" "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" 4.83671275893 "source-unit" "angstrom" } "b" { "source-value" 8.71240195881 "source-unit" "angstrom" } "c" { "source-value" 4.81207861 "source-unit" "angstrom" } }