{ "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" [ [ 0.5 0.053514 0.25 ] [ 0.5 0.946486 0.75 ] [ 0 0.553514 0.25 ] [ 0 0.446486 0.75 ] [ 0 0.163144 0.943004 ] [ 0 0.836856 0.056996 ] [ 0 0.836856 0.443004 ] [ 0 0.163144 0.556996 ] [ 0.5 0.663144 0.943004 ] [ 0.5 0.336856 0.056996 ] [ 0.5 0.336856 0.443004 ] [ 0.5 0.663144 0.556996 ] [ 0.5 0.780047 0.25 ] [ 0.5 0.219953 0.75 ] [ 0 0.280047 0.25 ] [ 0 0.719953 0.75 ] ] } "species" { "source-value" [ "Yb" "Yb" "Yb" "Yb" "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" 4.10185902 "source-unit" "angstrom" } "b" { "source-value" 9.81178032 "source-unit" "angstrom" } "c" { "source-value" 7.1361574 "source-unit" "angstrom" } }