{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.890964 0.25 ] [ 0 0.109036 0.75 ] [ 0.5 0.390964 0.25 ] [ 0.5 0.609036 0.75 ] [ 0.5 0.821705 0.75 ] [ 0.5 0.178295 0.25 ] [ 0 0.321705 0.75 ] [ 0 0.678295 0.25 ] [ 0 0.249761 0.25 ] [ 0 0.750239 0.75 ] [ 0.5 0.95919 0.75 ] [ 0.5 0.04081 0.25 ] [ 0.5 0.749761 0.25 ] [ 0.5 0.250239 0.75 ] [ 0 0.45919 0.75 ] [ 0 0.54081 0.25 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "Co" "Co" "Co" "Co" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.05591913 "source-unit" "angstrom" } "b" { "source-value" 16.47673159 "source-unit" "angstrom" } "c" { "source-value" 4.0227006 "source-unit" "angstrom" } }