{ "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 0.521974 0.821732 ] [ 0.25 0.021974 0.678268 ] [ 0.75 0.978026 0.321732 ] [ 0.75 0.478026 0.178268 ] [ 0.75 0.852586 0.926792 ] [ 0.25 0.147414 0.073208 ] [ 0.75 0.352586 0.573208 ] [ 0.25 0.647414 0.426792 ] [ 0.75 0.233201 0.893519 ] [ 0.25 0.266799 0.393519 ] [ 0.25 0.766799 0.106481 ] [ 0.75 0.733201 0.606481 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "Ca" "Ca" "Ca" "Ca" "Ge" "Ge" "Ge" "Ge" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.96925591 "source-unit" "angstrom" } "b" { "source-value" 8.15600261 "source-unit" "angstrom" } "c" { "source-value" 9.20733746 "source-unit" "angstrom" } }