[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Fe" "Fe" ] } "a" { "source-value" 2.8667457550764093 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.86674575507641e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-3m" } "temperature" { "source-value" 0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "c11" { "source-value" 336.12806880500835 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725355673 "si-unit" "kg / m s^2" "si-value" 336128068805.0084 } "c12" { "source-value" 170.3460961924128 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362022795 "si-unit" "kg / m s^2" "si-value" 170346096192.4128 } "c44" { "source-value" 169.1467157154035 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814775617 "si-unit" "kg / m s^2" "si-value" 169146715715.4035 } "excess" { "source-value" 0.18212419143167566 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133994 "si-unit" "kg / m s^2" "si-value" 182124191.4316757 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Fe" "Fe" ] } "a" { "source-value" 2.8667457550764093 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.86674575507641e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-3m" } "temperature" { "source-value" 0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "isothermal-bulk-modulus" { "source-value" 225.60675372994461 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578936604 "si-unit" "kg / m s^2" "si-value" 225606753729.9446 } } ]