[ { "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" 3.236557230353355 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.236557230353355e-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" 167.56967556478625 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725081107 "si-unit" "kg / m s^2" "si-value" 167569675564.7863 } "c12" { "source-value" 176.62660081604153 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362030029 "si-unit" "kg / m s^2" "si-value" 176626600816.0415 } "c44" { "source-value" 52.55940890396689 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812876522 "si-unit" "kg / m s^2" "si-value" 52559408903.96689 } "excess" { "source-value" 0.047760476758669394 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133217 "si-unit" "kg / m s^2" "si-value" 47760476.75866939 } } { "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" 3.236557230353355 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.236557230353355e-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" 173.60762573228976 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578887702 "si-unit" "kg / m s^2" "si-value" 173607625732.2898 } } ]