[ { "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" [ "C" "C" "C" "C" ] } "a" { "source-value" 2.7171389982104297 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.71713899821043e-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" 3970.1211923549076 "source-unit" "GPa" "source-std-uncert-value" 0.007335930731275097 "si-unit" "kg / m s^2" "si-value" 3970121192354.908 } "c12" { "source-value" 5684.977312267204 "source-unit" "GPa" "source-std-uncert-value" 0.005187286368374597 "si-unit" "kg / m s^2" "si-value" 5684977312267.204 } "c44" { "source-value" 124.0899399413127 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814041688 "si-unit" "kg / m s^2" "si-value" 124089939941.3127 } "excess" { "source-value" 0.0001300322812388593 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 130032.2812388593 } } { "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" [ "C" "C" "C" "C" ] } "a" { "source-value" 2.7171389982104297 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.71713899821043e-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" 5113.358605629772 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015835332805 "si-unit" "kg / m s^2" "si-value" 5113358605629.771 } } ]