[ { "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" 3.2368726730346684 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.236872673034669e-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" 167.72556603568867 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725081361 "si-unit" "kg / m s^2" "si-value" 167725566035.6887 } "c12" { "source-value" 166.68767350821057 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362018582 "si-unit" "kg / m s^2" "si-value" 166687673508.2106 } "c44" { "source-value" 50.9937889732305 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812851024 "si-unit" "kg / m s^2" "si-value" 50993788973.2305 } "excess" { "source-value" 3.996802888651444e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 3.996802888651444 } } { "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" 3.2368726730346684 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.236872673034669e-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" 167.0336376840366 "source-unit" "GPa" "source-std-uncert-value" 0.00423540157888152 "si-unit" "kg / m s^2" "si-value" 167033637684.0366 } } ]