[ { "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" 2.8599998205900192 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.859999820590019e-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" 192.26079838312387 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725121328 "si-unit" "kg / m s^2" "si-value" 192260798383.1239 } "c12" { "source-value" 96.13042841662873 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863619373145 "si-unit" "kg / m s^2" "si-value" 96130428416.62874 } "c44" { "source-value" 96.27414740733708 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813588594 "si-unit" "kg / m s^2" "si-value" 96274147407.33708 } "excess" { "source-value" 0.07190532428741081 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133356 "si-unit" "kg / m s^2" "si-value" 71905324.28741081 } } { "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" 2.8599998205900192 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.859999820590019e-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" 128.1738850721271 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578844975 "si-unit" "kg / m s^2" "si-value" 128173885072.1271 } } ]