[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Ni" "Ni" ] } "a" { "source-value" 2.768746592104435 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.768746592104435e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 142.212582846481 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307250398026 "si-unit" "kg / m s^2" "si-value" 142212582846.481 } "c12" { "source-value" 152.0537874479405 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362001726 "si-unit" "kg / m s^2" "si-value" 152053787447.9405 } "c44" { "source-value" 127.67897415809858 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814100144 "si-unit" "kg / m s^2" "si-value" 127678974158.0986 } "excess" { "source-value" 7.993605777302887e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 7.993605777302887 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Ni" "Ni" ] } "a" { "source-value" 2.768746592104435 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.768746592104435e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 148.77338591412064 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578864346 "si-unit" "kg / m s^2" "si-value" 148773385914.1206 } } ]