[ { "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" [ "Pb" "Pb" "Pb" "Pb" ] } "a" { "source-value" 4.94974747300148 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.94974747300148e-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" 55.58064129652765 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724898689 "si-unit" "kg / m s^2" "si-value" 55580641296.52765 } "c12" { "source-value" 45.413645956977255 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361878898 "si-unit" "kg / m s^2" "si-value" 45413645956.97726 } "c44" { "source-value" 19.408692294594832 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681233653 "si-unit" "kg / m s^2" "si-value" 19408692294.59483 } "excess" { "source-value" 1.3076317806340436e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 13076.31780634044 } } { "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" [ "Pb" "Pb" "Pb" "Pb" ] } "a" { "source-value" 4.94974747300148 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.94974747300148e-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" 48.80264440349405 "source-unit" "GPa" "source-std-uncert-value" 0.00423540157877033 "si-unit" "kg / m s^2" "si-value" 48802644403.49405 } } ]