[ { "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" 4.518424957990647 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.518424957990648e-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" 57.94850230631328 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724902545 "si-unit" "kg / m s^2" "si-value" 57948502306.31328 } "c12" { "source-value" 24.075173485909904 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361854318 "si-unit" "kg / m s^2" "si-value" 24075173485.9099 } "c44" { "source-value" 18.92747390623516 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681232869 "si-unit" "kg / m s^2" "si-value" 18927473906.23516 } "excess" { "source-value" 9.251858538545009e-10 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 0.9251858538545009 } } { "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" 4.518424957990647 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.518424957990648e-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" 35.36628309271103 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015787576926 "si-unit" "kg / m s^2" "si-value" 35366283092.71103 } } ]