[ { "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" 4.015757858753205 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.015757858753205e-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" 808.156358668259 "source-unit" "GPa" "source-std-uncert-value" 0.007335930726124561 "si-unit" "kg / m s^2" "si-value" 808156358668.259 } "c12" { "source-value" 461.0887736263741 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362357675 "si-unit" "kg / m s^2" "si-value" 461088773626.3741 } "c44" { "source-value" 462.04712903355477 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826819546684 "si-unit" "kg / m s^2" "si-value" 462047129033.5547 } "excess" { "source-value" 0.4585429795867968 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809135585 "si-unit" "kg / m s^2" "si-value" 458542979.5867968 } } { "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" 4.015757858753205 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.015757858753205e-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" 576.7779686403358 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015792668625 "si-unit" "kg / m s^2" "si-value" 576777968640.3358 } } ]