[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "a" { "source-value" 3.5213917642831802 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52139176428318e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-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" 260.44600447156137 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725232393 "si-unit" "kg / m s^2" "si-value" 260446004471.5614 } "c12" { "source-value" 150.6849201516853 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362000149 "si-unit" "kg / m s^2" "si-value" 150684920151.6853 } "c44" { "source-value" 131.01139280993877 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814154432 "si-unit" "kg / m s^2" "si-value" 131011392809.9388 } "excess" { "source-value" 0.000356761139149439 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 356761.139149439 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "a" { "source-value" 3.5213917642831802 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52139176428318e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-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" 187.27194825831066 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578900551 "si-unit" "kg / m s^2" "si-value" 187271948258.3107 } } ]