[ { "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" 2.8296494334936138 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.829649433493614e-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" 250.83431313301534 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307252167365 "si-unit" "kg / m s^2" "si-value" 250834313133.0154 } "c12" { "source-value" 108.37516388664426 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361951417 "si-unit" "kg / m s^2" "si-value" 108375163886.6443 } "c44" { "source-value" 110.08963002459218 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681381363 "si-unit" "kg / m s^2" "si-value" 110089630024.5922 } "excess" { "source-value" 4.588921835118325e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 4.588921835118325 } } { "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" 2.8296494334936138 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.829649433493614e-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" 155.86154696876795 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015788710125 "si-unit" "kg / m s^2" "si-value" 155861546968.7679 } } ]