{ "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 0.682901 0.939512 ] [ 0.75 0.317099 0.060488 ] [ 0.25 0.182901 0.560488 ] [ 0.75 0.817099 0.439512 ] [ 0.25 0.501654 0.294522 ] [ 0.75 0.498346 0.705478 ] [ 0.25 0.001654 0.205478 ] [ 0.75 0.998346 0.794522 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "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" 3.22986286 "source-unit" "angstrom" } "b" { "source-value" 5.59508073 "source-unit" "angstrom" } "c" { "source-value" 6.37250985 "source-unit" "angstrom" } }