[ { "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" 3.5200000256299973 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000025629997e-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" 255.31780639914754 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072522404 "si-unit" "kg / m s^2" "si-value" 255317806399.1476 } "c12" { "source-value" 155.80264640276314 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362006044 "si-unit" "kg / m s^2" "si-value" 155802646402.7632 } "c44" { "source-value" 129.79537431781566 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814134622 "si-unit" "kg / m s^2" "si-value" 129795374317.8157 } "excess" { "source-value" 0.032194948040860524 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133126 "si-unit" "kg / m s^2" "si-value" 32194948.04086052 } } { "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" 3.5200000256299973 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000025629997e-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" 188.97436640155792 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578902153 "si-unit" "kg / m s^2" "si-value" 188974366401.5579 } } ]