[ { "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" [ "Au" "Au" ] } "a" { "source-value" 3.2327047616243383 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.232704761624338e-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" 163.9996117699744 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725075293 "si-unit" "kg / m s^2" "si-value" 163999611769.9744 } "c12" { "source-value" 162.53167540728725 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362013794 "si-unit" "kg / m s^2" "si-value" 162531675407.2873 } "c44" { "source-value" 162.8953611141707 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681467379 "si-unit" "kg / m s^2" "si-value" 162895361114.1707 } "excess" { "source-value" 32.977481235548275 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809322866 "si-unit" "kg / m s^2" "si-value" 32977481235.54827 } } { "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" [ "Au" "Au" ] } "a" { "source-value" 3.2327047616243383 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.232704761624338e-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" 163.02098752818296 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578877746 "si-unit" "kg / m s^2" "si-value" 163020987528.183 } } ]