[ { "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" [ "Nd" "Nd" "Nd" "Nd" ] } "a" { "source-value" 5.176021620631218 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.176021620631218e-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" 58.98520814274966 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724904234 "si-unit" "kg / m s^2" "si-value" 58985208142.74966 } "c12" { "source-value" 25.75441035161768 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361856254 "si-unit" "kg / m s^2" "si-value" 25754410351.61768 } "c44" { "source-value" 26.32993192764357 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812449268 "si-unit" "kg / m s^2" "si-value" 26329931927.64357 } "excess" { "source-value" 4.937938946626396e-06 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 4937.938946626397 } } { "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" [ "Nd" "Nd" "Nd" "Nd" ] } "a" { "source-value" 5.176021620631218 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.176021620631218e-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" 36.83134294866167 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578759072 "si-unit" "kg / m s^2" "si-value" 36831342948.66167 } } ]