{ "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 0.51914 0.683084 ] [ 0.25 0.01914 0.816916 ] [ 0.75 0.98086 0.183084 ] [ 0.75 0.48086 0.316916 ] [ 0.75 0.36181 0.939403 ] [ 0.25 0.13819 0.439403 ] [ 0.75 0.86181 0.560597 ] [ 0.25 0.63819 0.060597 ] [ 0.25 0.775538 0.387122 ] [ 0.25 0.275538 0.112878 ] [ 0.75 0.224462 0.612878 ] [ 0.75 0.724462 0.887122 ] ] } "species" { "source-value" [ "Zr" "Zr" "Zr" "Zr" "Co" "Co" "Co" "Co" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.7012419 "source-unit" "angstrom" } "b" { "source-value" 6.34964647 "source-unit" "angstrom" } "c" { "source-value" 7.17578095 "source-unit" "angstrom" } }