[ { "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" 2.851000025868416 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.851000025868416e-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" 265.77526601148026 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725241075 "si-unit" "kg / m s^2" "si-value" 265775266011.4803 } "c12" { "source-value" 127.30331025899925 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361973219 "si-unit" "kg / m s^2" "si-value" 127303310258.9993 } "c44" { "source-value" 126.08028881517612 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814074106 "si-unit" "kg / m s^2" "si-value" 126080288815.1761 } "excess" { "source-value" 2.2204460492508024e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 2.220446049250802 } } { "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" 2.851000025868416 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.851000025868416e-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" 173.46062884315955 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578887564 "si-unit" "kg / m s^2" "si-value" 173460628843.1595 } } ]