[ { "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" [ "Ar" "Ar" "Ar" "Ar" ] } "a" { "source-value" 5.292160376906395 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.292160376906395e-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" 3.7160310833828873 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724814206 "si-unit" "kg / m s^2" "si-value" 3716031083.382887 } "c12" { "source-value" 2.135846060398469 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361829049 "si-unit" "kg / m s^2" "si-value" 2135846060.398469 } "c44" { "source-value" 2.139243221617468 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812055224 "si-unit" "kg / m s^2" "si-value" 2139243221.617468 } "excess" { "source-value" 0.0016006553385983049 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132953 "si-unit" "kg / m s^2" "si-value" 1600655.338598305 } } { "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" [ "Ar" "Ar" "Ar" "Ar" ] } "a" { "source-value" 5.292160376906395 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.292160376906395e-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" 2.662574401393275 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578726937 "si-unit" "kg / m s^2" "si-value" 2662574401.393275 } } ]