[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Pd" "Pd" ] } "a" { "source-value" 3.08913716673851 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.08913716673851e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 164.64603913672067 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307250763445 "si-unit" "kg / m s^2" "si-value" 164646039136.7207 } "c12" { "source-value" 181.16810009283515 "source-unit" "GPa" "source-std-uncert-value" 0.00518728636203526 "si-unit" "kg / m s^2" "si-value" 181168100092.8351 } "c44" { "source-value" 94.59641820207025 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813561265 "si-unit" "kg / m s^2" "si-value" 94596418202.07025 } "excess" { "source-value" 0.0389458286361437 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133165 "si-unit" "kg / m s^2" "si-value" 38945828.6361437 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Pd" "Pd" ] } "a" { "source-value" 3.08913716673851 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.08913716673851e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 175.660746440797 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578889633 "si-unit" "kg / m s^2" "si-value" 175660746440.797 } } ]