[ { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.615000158548355 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.615000158548355e-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" 167.26348916410802 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307250806085 "si-unit" "kg / m s^2" "si-value" 167263489164.108 } "c12" { "source-value" 124.15389823597316 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361969591 "si-unit" "kg / m s^2" "si-value" 124153898235.9732 } "c44" { "source-value" 76.64200398403084 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813268802 "si-unit" "kg / m s^2" "si-value" 76642003984.03084 } "excess" { "source-value" 0.09731723856397197 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133503 "si-unit" "kg / m s^2" "si-value" 97317238.56397197 } } { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.615000158548355 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.615000158548355e-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" 138.52376187868475 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578854707 "si-unit" "kg / m s^2" "si-value" 138523761878.6848 } } ]