{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Im3" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.75 0.75 ] [ 0.75 0.75 0.25 ] [ 0.75 0.25 0.75 ] [ 0.75 0.75 0.75 ] [ 0.75 0.25 0.25 ] [ 0.25 0.25 0.75 ] [ 0.25 0.75 0.25 ] [ 0.25 0.25 0.25 ] [ 0.151985 0 0.658793 ] [ 0.341207 0.848015 0 ] [ 0.848015 0 0.658793 ] [ 0.151985 0 0.341207 ] [ 0.341207 0.151985 0 ] [ 0 0.658793 0.151985 ] [ 0 0.341207 0.848015 ] [ 0 0.658793 0.848015 ] [ 0.658793 0.848015 0 ] [ 0.848015 0 0.341207 ] [ 0.658793 0.151985 0 ] [ 0 0.341207 0.151985 ] [ 0.651985 0.5 0.158793 ] [ 0.841207 0.348015 0.5 ] [ 0.348015 0.5 0.158793 ] [ 0.651985 0.5 0.841207 ] [ 0.841207 0.651985 0.5 ] [ 0.5 0.158793 0.651985 ] [ 0.5 0.841207 0.348015 ] [ 0.5 0.158793 0.348015 ] [ 0.158793 0.348015 0.5 ] [ 0.348015 0.5 0.841207 ] [ 0.158793 0.651985 0.5 ] [ 0.5 0.841207 0.651985 ] ] } "species" { "source-value" [ "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.27045071249 "source-unit" "angstrom" } }