[ { "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" [ "Pd" "Pd" ] } "a" { "source-value" 3.086859412491322 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.086859412491322e-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" 197.47880219260682 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725129825 "si-unit" "kg / m s^2" "si-value" 197478802192.6068 } "c12" { "source-value" 194.7418537226708 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362050894 "si-unit" "kg / m s^2" "si-value" 194741853722.6708 } "c44" { "source-value" 73.79398869805428 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813222413 "si-unit" "kg / m s^2" "si-value" 73793988698.05428 } "excess" { "source-value" 0.058790414018511365 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133282 "si-unit" "kg / m s^2" "si-value" 58790414.01851136 } } { "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" [ "Pd" "Pd" ] } "a" { "source-value" 3.086859412491322 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.086859412491322e-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" 195.65416987931613 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578908435 "si-unit" "kg / m s^2" "si-value" 195654169879.3161 } } ]