[ { "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" [ "I" "I" "I" "I" ] } "a" { "source-value" 3.8232300952076907 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.823230095207691e-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" 1678.2839011975077 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307275419165 "si-unit" "kg / m s^2" "si-value" 1678283901197.508 } "c12" { "source-value" 957.5348356162508 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362929486 "si-unit" "kg / m s^2" "si-value" 957534835616.2509 } "c44" { "source-value" 959.5250256876616 "source-unit" "GPa" "source-std-uncert-value" 0.001833982682765012 "si-unit" "kg / m s^2" "si-value" 959525025687.6616 } "excess" { "source-value" 0.9522481623967578 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913843 "si-unit" "kg / m s^2" "si-value" 952248162.3967578 } } { "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" [ "I" "I" "I" "I" ] } "a" { "source-value" 3.8232300952076907 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.823230095207691e-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" 1197.7845241433363 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015798508875 "si-unit" "kg / m s^2" "si-value" 1197784524143.336 } } ]