[ { "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" 3.614939033985138 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.614939033985138e-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" 167.27215519377967 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725080623 "si-unit" "kg / m s^2" "si-value" 167272155193.7797 } "c12" { "source-value" 120.79491152112409 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361965722 "si-unit" "kg / m s^2" "si-value" 120794911521.1241 } "c44" { "source-value" 75.65315964813506 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813252695 "si-unit" "kg / m s^2" "si-value" 75653159648.13506 } "excess" { "source-value" 0.24109157958923413 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913433 "si-unit" "kg / m s^2" "si-value" 241091579.5892341 } } { "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" 3.614939033985138 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.614939033985138e-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" 136.28732607867596 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015788526045 "si-unit" "kg / m s^2" "si-value" 136287326078.676 } } ]