[ { "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" [ "Pd" "Pd" "Pd" "Pd" ] } "a" { "source-value" 3.8900000602006912 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.890000060200691e-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" 234.53124439444605 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725190181 "si-unit" "kg / m s^2" "si-value" 234531244394.446 } "c12" { "source-value" 175.9500071963922 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863620292505 "si-unit" "kg / m s^2" "si-value" 175950007196.3922 } "c44" { "source-value" 70.92576661969024 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813175693 "si-unit" "kg / m s^2" "si-value" 70925766619.69023 } "excess" { "source-value" 1.4802973661672014e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 1.480297366167201 } } { "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" [ "Pd" "Pd" "Pd" "Pd" ] } "a" { "source-value" 3.8900000602006912 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.890000060200691e-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" 195.47708626241015 "source-unit" "GPa" "source-std-uncert-value" 0.00423540157890827 "si-unit" "kg / m s^2" "si-value" 195477086262.4102 } } ]