{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0.016917 0.936924 0.75 ] [ 0.516917 0.563076 0.25 ] [ 0.483083 0.436924 0.75 ] [ 0.983083 0.063076 0.25 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0 0.5 0 ] [ 0.698722 0.301024 0.447091 ] [ 0.198722 0.198976 0.552909 ] [ 0.801278 0.801025 0.052909 ] [ 0.301278 0.698975 0.947091 ] [ 0.301278 0.698975 0.552909 ] [ 0.801278 0.801025 0.447091 ] [ 0.198722 0.198976 0.947091 ] [ 0.698722 0.301024 0.052909 ] [ 0.101968 0.467668 0.25 ] [ 0.601968 0.032332 0.75 ] [ 0.398032 0.967668 0.25 ] [ 0.898032 0.532332 0.75 ] ] } "species" { "source-value" [ "Gd" "Gd" "Gd" "Gd" "Ga" "Ga" "Ga" "Ga" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.37317138 "source-unit" "angstrom" } "b" { "source-value" 5.61965195 "source-unit" "angstrom" } "c" { "source-value" 7.70335431 "source-unit" "angstrom" } }