[ { "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" 2.8886456787586208 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.888645678758621e-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" 218.6681195996706 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725164341 "si-unit" "kg / m s^2" "si-value" 218668119599.6706 } "c12" { "source-value" 142.27043802905172 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361990457 "si-unit" "kg / m s^2" "si-value" 142270438029.0517 } "c44" { "source-value" 130.10766113466613 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681413971 "si-unit" "kg / m s^2" "si-value" 130107661134.6661 } "excess" { "source-value" 0.07669967239111754 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133386 "si-unit" "kg / m s^2" "si-value" 76699672.39111754 } } { "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" 2.8886456787586208 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.888645678758621e-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" 167.73633188592467 "source-unit" "GPa" "source-std-uncert-value" 0.00423540157888218 "si-unit" "kg / m s^2" "si-value" 167736331885.9247 } } ]