[ { "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" 3.521392315626145 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.521392315626145e-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" 245.09257042861256 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307252073855 "si-unit" "kg / m s^2" "si-value" 245092570428.6125 } "c12" { "source-value" 177.3925900998954 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362030911 "si-unit" "kg / m s^2" "si-value" 177392590099.8954 } "c44" { "source-value" 133.1134508842107 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681418867 "si-unit" "kg / m s^2" "si-value" 133113450884.2107 } "excess" { "source-value" 3.5527136788012834e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 3.552713678801283 } } { "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" 3.521392315626145 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.521392315626145e-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" 199.95925020946777 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578912484 "si-unit" "kg / m s^2" "si-value" 199959250209.4678 } } ]