{ "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 0.491819 0.796791 ] [ 0.75 0.508181 0.203209 ] [ 0.25 0.991819 0.703209 ] [ 0.75 0.008181 0.296791 ] [ 0.25 0.819361 0.084412 ] [ 0.75 0.180639 0.915588 ] [ 0.25 0.319361 0.415588 ] [ 0.75 0.680639 0.584412 ] [ 0.75 0.771287 0.914073 ] [ 0.25 0.228713 0.085927 ] [ 0.75 0.271287 0.585927 ] [ 0.25 0.728713 0.414073 ] ] } "species" { "source-value" [ "U" "U" "U" "U" "Ge" "Ge" "Ge" "Ge" "Ir" "Ir" "Ir" "Ir" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.36749967 "source-unit" "angstrom" } "b" { "source-value" 6.67557229 "source-unit" "angstrom" } "c" { "source-value" 7.715411 "source-unit" "angstrom" } }