[ { "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" 2.8664998710155487 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866499871015549e-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" 245.9097637632436 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725208717 "si-unit" "kg / m s^2" "si-value" 245909763763.2436 } "c12" { "source-value" 138.28638768490214 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863619858685 "si-unit" "kg / m s^2" "si-value" 138286387684.9021 } "c44" { "source-value" 122.1844347608535 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681401065 "si-unit" "kg / m s^2" "si-value" 122184434760.8535 } "excess" { "source-value" 0.05965985720262653 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133287 "si-unit" "kg / m s^2" "si-value" 59659857.20262653 } } { "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" 2.8664998710155487 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866499871015549e-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" 174.16084637768262 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578888222 "si-unit" "kg / m s^2" "si-value" 174160846377.6826 } } ]