[ { "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" 2.871003895998001 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.871003895998001e-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" 63.44913623303204 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724911505 "si-unit" "kg / m s^2" "si-value" 63449136233.03204 } "c12" { "source-value" 171.92803465767284 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362024617 "si-unit" "kg / m s^2" "si-value" 171928034657.6729 } "c44" { "source-value" 83.05772656138241 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681337331 "si-unit" "kg / m s^2" "si-value" 83057726561.38242 } "excess" { "source-value" 3.4046839421845634e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 3.404683942184563 } } { "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" 2.871003895998001 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.871003895998001e-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" 135.76840184945922 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578852116 "si-unit" "kg / m s^2" "si-value" 135768401849.4592 } } ]