{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.677311 0.926864 ] [ 0.75 0.322689 0.073136 ] [ 0.25 0.177311 0.573136 ] [ 0.75 0.822689 0.426864 ] [ 0.25 0.504231 0.308925 ] [ 0.75 0.495769 0.691075 ] [ 0.25 0.004231 0.191075 ] [ 0.75 0.995769 0.808925 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Pd" "Pd" "Pd" "Pd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.47649346 "source-unit" "angstrom" } "b" { "source-value" 5.62856977 "source-unit" "angstrom" } "c" { "source-value" 6.17890533 "source-unit" "angstrom" } }