{ "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" [ [ 0.75 0.716128 0.89245 ] [ 0.25 0.283872 0.10755 ] [ 0.75 0.216128 0.60755 ] [ 0.25 0.783872 0.39245 ] [ 0.75 0.159015 0.930402 ] [ 0.25 0.840985 0.069598 ] [ 0.75 0.659015 0.569598 ] [ 0.25 0.340985 0.430402 ] [ 0.75 0.039058 0.300285 ] [ 0.25 0.960942 0.699715 ] [ 0.75 0.539058 0.199715 ] [ 0.25 0.460942 0.800285 ] ] } "species" { "source-value" [ "Sb" "Sb" "Sb" "Sb" "Rh" "Rh" "Rh" "Rh" "Rh" "Rh" "Rh" "Rh" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.22276836 "source-unit" "angstrom" } "b" { "source-value" 5.84719142 "source-unit" "angstrom" } "c" { "source-value" 8.05157955 "source-unit" "angstrom" } }