[ { "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" [ "Na" "Na" "Na" "Na" ] } "a" { "source-value" 5.445499843358995 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.445499843358995e-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" 7.550262944635009 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724820449 "si-unit" "kg / m s^2" "si-value" 7550262944.63501 } "c12" { "source-value" 5.714556613764855 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361833171 "si-unit" "kg / m s^2" "si-value" 5714556613.764855 } "c44" { "source-value" 5.874904411952337 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812116076 "si-unit" "kg / m s^2" "si-value" 5874904411.952337 } "excess" { "source-value" 0.08012794235532646 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133404 "si-unit" "kg / m s^2" "si-value" 80127942.35532646 } } { "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" [ "Na" "Na" "Na" "Na" ] } "a" { "source-value" 5.445499843358995 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.445499843358995e-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" 6.326458724054906 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578730382 "si-unit" "kg / m s^2" "si-value" 6326458724.054907 } } ]