[ { "short-name" { "source-value" [ "fcc" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" 3.65836434811e-10 "source-value" 3.65836434811 } "temperature" { "si-unit" "K" "source-unit" "K" "si-value" 0.0 "source-value" 0 } "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "c44" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 9653357026.929998 "source-std-uncert-value" 0.0018339826812177626 "source-value" 9.653357026927026 } "space-group" { "source-value" "Fm-3m" } "excess" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 2.51650552248 "source-std-uncert-value" 0.0025936431809132944 "source-value" 2.5165055224842417e-09 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "c12" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 40321949587.3 "source-std-uncert-value" 0.005187286361873032 "source-value" 40.32194958726087 } "c11" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 68012211123.39999 "source-std-uncert-value" 0.007335930724918938 "source-value" 68.0122111234177 } "cauchy-stress" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-value" [ 0 0 0 0 0 0 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "instance-id" 1 } { "short-name" { "source-value" [ "fcc" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" 3.65836434811e-10 "source-value" 3.65836434811 } "temperature" { "si-unit" "K" "source-unit" "K" "si-value" 0.0 "source-value" 0 } "isothermal-bulk-modulus" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 49552036766.0 "source-std-uncert-value" 0.0042354015787710335 "source-value" 49.552036765979814 } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "space-group" { "source-value" "Fm-3m" } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "cauchy-stress" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-value" [ 0 0 0 0 0 0 ] } "species" { "source-value" [ "Fe" "Fe" "Fe" "Fe" ] } "instance-id" 2 } ]