[ { "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" 4.493705868721008 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.493705868721008e-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" 50.799491171382805 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307248909 "si-unit" "kg / m s^2" "si-value" 50799491171.3828 } "c12" { "source-value" 32.29363851058291 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863618637865 "si-unit" "kg / m s^2" "si-value" 32293638510.58291 } "c44" { "source-value" 29.190412483547505 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812495863 "si-unit" "kg / m s^2" "si-value" 29190412483.5475 } "excess" { "source-value" 0.028109614265883483 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133105 "si-unit" "kg / m s^2" "si-value" 28109614.26588348 } } { "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" 4.493705868721008 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.493705868721008e-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" 38.462256064182874 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578760605 "si-unit" "kg / m s^2" "si-value" 38462256064.18288 } } ]