[ { "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" 3.5222107768058777 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.522210776805878e-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" 269.48289125060177 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725247112 "si-unit" "kg / m s^2" "si-value" 269482891250.6018 } "c12" { "source-value" 149.6269635754144 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361998932 "si-unit" "kg / m s^2" "si-value" 149626963575.4144 } "c44" { "source-value" 135.35228543751427 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814225137 "si-unit" "kg / m s^2" "si-value" 135352285437.5143 } "excess" { "source-value" 0.002797368855075557 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132957 "si-unit" "kg / m s^2" "si-value" 2797368.855075557 } } { "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" 3.5222107768058777 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.522210776805878e-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" 189.57893946714353 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578902722 "si-unit" "kg / m s^2" "si-value" 189578939467.1435 } } ]