[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" 4.032073378562927 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.032073378562927e-10 } "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 ] ] } "space-group" { "source-value" "Fm-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" 118.38623571002199 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725000993 "si-unit" "kg / m s^2" "si-value" 118386235710.022 } "c12" { "source-value" 62.56168014337934 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361898649 "si-unit" "kg / m s^2" "si-value" 62561680143.37934 } "c44" { "source-value" 36.86177724705177 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812620824 "si-unit" "kg / m s^2" "si-value" 36861777247.05177 } "excess" { "source-value" 0.12420753818060735 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913366 "si-unit" "kg / m s^2" "si-value" 124207538.1806073 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" 4.032073378562927 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.032073378562927e-10 } "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 ] ] } "space-group" { "source-value" "Fm-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" 81.16986533226022 "source-unit" "GPa" "source-std-uncert-value" 0.00423540157880077 "si-unit" "kg / m s^2" "si-value" 81169865332.26021 } } ]