[ { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.6336620748043056 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.633662074804306e-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" 172.67933169292382 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307250894295 "si-unit" "kg / m s^2" "si-value" 172679331692.9238 } "c12" { "source-value" 132.85477595029332 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361979612 "si-unit" "kg / m s^2" "si-value" 132854775950.2933 } "c44" { "source-value" 87.27979942781663 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813442083 "si-unit" "kg / m s^2" "si-value" 87279799427.81662 } "excess" { "source-value" 0.006723180086729564 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913298 "si-unit" "kg / m s^2" "si-value" 6723180.086729564 } } { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.6336620748043056 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.633662074804306e-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" 146.12962786450348 "source-unit" "GPa" "source-std-uncert-value" 0.00423540157886186 "si-unit" "kg / m s^2" "si-value" 146129627864.5035 } } ]