[ { "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" 3.086822435259819 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.086822435259819e-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" 159.5797422104417 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725068092 "si-unit" "kg / m s^2" "si-value" 159579742210.4417 } "c12" { "source-value" 181.20843323410642 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362035306 "si-unit" "kg / m s^2" "si-value" 181208433234.1064 } "c44" { "source-value" 94.55754424261137 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813560632 "si-unit" "kg / m s^2" "si-value" 94557544242.61137 } "excess" { "source-value" 0.04094085914730719 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913318 "si-unit" "kg / m s^2" "si-value" 40940859.14730719 } } { "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" 3.086822435259819 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.086822435259819e-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" 173.9988695595515 "source-unit" "GPa" "source-std-uncert-value" 0.00423540157888807 "si-unit" "kg / m s^2" "si-value" 173998869559.5515 } } ]