[ { "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" 5.499005943536759 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.499005943536759e-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" 14.601425053350562 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724831936 "si-unit" "kg / m s^2" "si-value" 14601425053.35056 } "c12" { "source-value" 16.265128650090954 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361845324 "si-unit" "kg / m s^2" "si-value" 16265128650.09095 } "c44" { "source-value" 16.265513002659244 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681228533 "si-unit" "kg / m s^2" "si-value" 16265513002.65924 } "excess" { "source-value" 1.6653345369381016e-10 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 0.1665334536938102 } } { "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" 5.499005943536759 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.499005943536759e-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" 15.710560784510822 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578739208 "si-unit" "kg / m s^2" "si-value" 15710560784.51082 } } ]