[ { "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" [ "Au" "Au" ] } "a" { "source-value" 3.206937551498413 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.206937551498413e-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" 193.49722626675714 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072512334 "si-unit" "kg / m s^2" "si-value" 193497226266.7571 } "c12" { "source-value" 216.10496250154677 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863620755 "si-unit" "kg / m s^2" "si-value" 216104962501.5468 } "c44" { "source-value" 66.82362893563415 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813108875 "si-unit" "kg / m s^2" "si-value" 66823628935.63415 } "excess" { "source-value" 0.0553852295877873 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913326 "si-unit" "kg / m s^2" "si-value" 55385229.5877873 } } { "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" [ "Au" "Au" ] } "a" { "source-value" 3.206937551498413 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.206937551498413e-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" 208.56905042328356 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015789205805 "si-unit" "kg / m s^2" "si-value" 208569050423.2836 } } ]