[ { "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" 2.863645777106285 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.863645777106285e-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" 242.171894688242 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725202626 "si-unit" "kg / m s^2" "si-value" 242171894688.242 } "c12" { "source-value" 138.41582139428223 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361986019 "si-unit" "kg / m s^2" "si-value" 138415821394.2822 } "c44" { "source-value" 121.61517762120467 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814001373 "si-unit" "kg / m s^2" "si-value" 121615177621.2047 } "excess" { "source-value" 0.07417699314043796 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913337 "si-unit" "kg / m s^2" "si-value" 74176993.14043796 } } { "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" 2.863645777106285 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.863645777106285e-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" 173.00117915893549 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578887132 "si-unit" "kg / m s^2" "si-value" 173001179158.9355 } } ]