{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1nm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.71081 0.006111 ] [ 0.5 0.28919 0.506111 ] [ 0 0.444465 0.693168 ] [ 0.5 0.555535 0.193168 ] [ 0.5 0.947627 0.800721 ] [ 0 0.052373 0.300721 ] ] } "species" { "source-value" [ "Fe" "Fe" "O" "O" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.10574822 "source-unit" "angstrom" } "b" { "source-value" 4.73134574 "source-unit" "angstrom" } "c" { "source-value" 4.76146893 "source-unit" "angstrom" } }