[ { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.620000052452088 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.620000052452088e-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" 170.02243187217852 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725085103 "si-unit" "kg / m s^2" "si-value" 170022431872.1785 } "c12" { "source-value" 121.77725097831012 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361966853 "si-unit" "kg / m s^2" "si-value" 121777250978.3101 } "c44" { "source-value" 76.59052246749957 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813267965 "si-unit" "kg / m s^2" "si-value" 76590522467.49957 } "excess" { "source-value" 0.14229373871783754 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133764 "si-unit" "kg / m s^2" "si-value" 142293738.7178375 } } { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.620000052452088 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.620000052452088e-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" 137.8589779429329 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015788540825 "si-unit" "kg / m s^2" "si-value" 137858977942.9329 } } ]