[ { "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" 4.512620940804482 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.512620940804483e-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" 54.56838076631498 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724897039 "si-unit" "kg / m s^2" "si-value" 54568380766.31498 } "c12" { "source-value" 27.770295686130883 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863618585745 "si-unit" "kg / m s^2" "si-value" 27770295686.13088 } "c44" { "source-value" 25.89226528775076 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681244214 "si-unit" "kg / m s^2" "si-value" 25892265287.75076 } "excess" { "source-value" 0.00023834556550644513 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 238345.5655064451 } } { "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" 4.512620940804482 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.512620940804483e-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" 36.70299071285891 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578758949 "si-unit" "kg / m s^2" "si-value" 36702990712.85891 } } ]