[ { "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" 4.909122220426797 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.909122220426797e-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" 43.94471932879086 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307248797335 "si-unit" "kg / m s^2" "si-value" 43944719328.79086 } "c12" { "source-value" 36.732962148463876 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361868899 "si-unit" "kg / m s^2" "si-value" 36732962148.46387 } "c44" { "source-value" 7.242483222408025 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812138352 "si-unit" "kg / m s^2" "si-value" 7242483222.408026 } "excess" { "source-value" 1.950077136807194e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 19500.77136807194 } } { "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" 4.909122220426797 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.909122220426797e-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" 39.13688120857287 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578761239 "si-unit" "kg / m s^2" "si-value" 39136881208.57288 } } ]