{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.950095 0.25 ] [ 0 0.049905 0.75 ] [ 0.5 0.450095 0.25 ] [ 0.5 0.549905 0.75 ] [ 0.5 0.166035 0.062137 ] [ 0.5 0.833965 0.562137 ] [ 0.5 0.166035 0.437863 ] [ 0.5 0.833965 0.937863 ] [ 0 0.666035 0.062137 ] [ 0 0.333965 0.562137 ] [ 0 0.666035 0.437863 ] [ 0 0.333965 0.937863 ] [ 0 0.230212 0.25 ] [ 0 0.769788 0.75 ] [ 0.5 0.730212 0.25 ] [ 0.5 0.269788 0.75 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] ] } "species" { "source-value" [ "Dy" "Dy" "Dy" "Dy" "Fe" "Fe" "Fe" "Fe" "Fe" "Fe" "Fe" "Fe" "Si" "Si" "Si" "Si" "C" "C" "C" "C" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.75281597 "source-unit" "angstrom" } "b" { "source-value" 10.4146619 "source-unit" "angstrom" } "c" { "source-value" 6.75432342 "source-unit" "angstrom" } }