[ { "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" 2.851000159978866 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.851000159978866e-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" 231.27174800431644 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725184872 "si-unit" "kg / m s^2" "si-value" 231271748004.3164 } "c12" { "source-value" 134.50987880683957 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361981518 "si-unit" "kg / m s^2" "si-value" 134509878806.8396 } "c44" { "source-value" 116.19101585316544 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813913017 "si-unit" "kg / m s^2" "si-value" 116191015853.1654 } "excess" { "source-value" 3.1086244689511232e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 3.108624468951123 } } { "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" 2.851000159978866 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.851000159978866e-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" 166.7638352059985 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578881266 "si-unit" "kg / m s^2" "si-value" 166763835205.9985 } } ]