[ { "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" [ "Cu" "Cu" ] } "a" { "source-value" 2.859396114945412 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.859396114945412e-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" 146.2608739562266 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725046398 "si-unit" "kg / m s^2" "si-value" 146260873956.2266 } "c12" { "source-value" 137.95217261091565 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361985483 "si-unit" "kg / m s^2" "si-value" 137952172610.9156 } "c44" { "source-value" 91.93677286699055 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681351794 "si-unit" "kg / m s^2" "si-value" 91936772866.99055 } "excess" { "source-value" 0.04078559149671859 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913318 "si-unit" "kg / m s^2" "si-value" 40785591.49671859 } } { "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" [ "Cu" "Cu" ] } "a" { "source-value" 2.859396114945412 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.859396114945412e-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" 140.72173972601928 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578856775 "si-unit" "kg / m s^2" "si-value" 140721739726.0193 } } ]