[ { "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" 5.298585683107377 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.298585683107378e-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" 11.613272969726367 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724827069 "si-unit" "kg / m s^2" "si-value" 11613272969.72637 } "c12" { "source-value" 6.285180086978515 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361833828 "si-unit" "kg / m s^2" "si-value" 6285180086.978515 } "c44" { "source-value" 5.021339883283233 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812102172 "si-unit" "kg / m s^2" "si-value" 5021339883.283234 } "excess" { "source-value" 6.242043918785547e-07 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 624.2043918785547 } } { "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" 5.298585683107377 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.298585683107378e-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" 8.061211047894464 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578732014 "si-unit" "kg / m s^2" "si-value" 8061211047.894464 } } ]