[ { "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" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" 4.210718545317654 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.210718545317654e-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" 56.11963473870252 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307248995675 "si-unit" "kg / m s^2" "si-value" 56119634738.70252 } "c12" { "source-value" 30.29202859217818 "source-unit" "GPa" "source-std-uncert-value" 0.00518728636186148 "si-unit" "kg / m s^2" "si-value" 30292028592.17818 } "c44" { "source-value" 9.128522931188241 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812169072 "si-unit" "kg / m s^2" "si-value" 9128522931.188242 } "excess" { "source-value" 0.06823184039996104 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913334 "si-unit" "kg / m s^2" "si-value" 68231840.39996104 } } { "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" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" 4.210718545317654 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.210718545317654e-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" 38.90123064101962 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578761018 "si-unit" "kg / m s^2" "si-value" 38901230641.01962 } } ]