[ { "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" 4.4954258278012285 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.495425827801229e-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" 57.336468951205745 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724901549 "si-unit" "kg / m s^2" "si-value" 57336468951.20574 } "c12" { "source-value" 31.456291692625214 "source-unit" "GPa" "source-std-uncert-value" 0.00518728636186282 "si-unit" "kg / m s^2" "si-value" 31456291692.62521 } "c44" { "source-value" 28.101750618409557 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812478134 "si-unit" "kg / m s^2" "si-value" 28101750618.40956 } "excess" { "source-value" 0.050257969193752854 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913323 "si-unit" "kg / m s^2" "si-value" 50257969.19375286 } } { "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" 4.4954258278012285 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.495425827801229e-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" 40.08301744548539 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578762129 "si-unit" "kg / m s^2" "si-value" 40083017445.48539 } } ]