[ { "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" 3.8782314434647556 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.878231443464756e-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" 82.0758221695135 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724941845 "si-unit" "kg / m s^2" "si-value" 82075822169.5135 } "c12" { "source-value" 46.82786917395538 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361880526 "si-unit" "kg / m s^2" "si-value" 46827869173.95538 } "c44" { "source-value" 46.9251973778406 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812784747 "si-unit" "kg / m s^2" "si-value" 46925197377.8406 } "excess" { "source-value" 0.04656934586105008 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133213 "si-unit" "kg / m s^2" "si-value" 46569345.86105008 } } { "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" 3.8782314434647556 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.878231443464756e-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" 58.57718683914142 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015787795215 "si-unit" "kg / m s^2" "si-value" 58577186839.14142 } } ]