{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmmm" } "basis-atom-coordinates" { "source-value" [ [ 0.704243 0 0 ] [ 0.295757 0 0 ] [ 0.204243 0.5 0 ] [ 0.795757 0.5 0 ] [ 0 0.783588 0.5 ] [ 0 0.216412 0.5 ] [ 0.5 0.283588 0.5 ] [ 0.5 0.716412 0.5 ] ] } "species" { "source-value" [ "V" "V" "V" "V" "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" 5.81546650513 "source-unit" "angstrom" } "b" { "source-value" 6.77263528842 "source-unit" "angstrom" } "c" { "source-value" 2.8226875 "source-unit" "angstrom" } }