[ { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.61472986638546 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.61472986638546e-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" 184.17280816570553 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307251081515 "si-unit" "kg / m s^2" "si-value" 184172808165.7055 } "c12" { "source-value" 115.3248640732365 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361959421 "si-unit" "kg / m s^2" "si-value" 115324864073.2365 } "c44" { "source-value" 68.85196969498703 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813141913 "si-unit" "kg / m s^2" "si-value" 68851969694.98703 } "excess" { "source-value" 1.2766084485825943e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 12766.08448582594 } } { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.61472986638546 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.61472986638546e-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" 138.27417877072617 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578854472 "si-unit" "kg / m s^2" "si-value" 138274178770.7262 } } ]