[ { "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" [ "Mg" "Mg" "Mg" "Mg" ] } "a" { "source-value" 4.505757522583009 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.505757522583009e-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" 51.62402332578798 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724892242 "si-unit" "kg / m s^2" "si-value" 51624023325.78798 } "c12" { "source-value" 28.561340194990606 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361859486 "si-unit" "kg / m s^2" "si-value" 28561340194.9906 } "c44" { "source-value" 23.06183282201103 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812396036 "si-unit" "kg / m s^2" "si-value" 23061832822.01103 } "excess" { "source-value" 0.015762926371587264 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133035 "si-unit" "kg / m s^2" "si-value" 15762926.37158727 } } { "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" [ "Mg" "Mg" "Mg" "Mg" ] } "a" { "source-value" 4.505757522583009 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.505757522583009e-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" 36.24890123858973 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578758523 "si-unit" "kg / m s^2" "si-value" 36248901238.58973 } } ]