[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Zr" "Zr" ] } "a" { "source-value" 3.852408058941365 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.852408058941365e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 965.8436832019148 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307263814195 "si-unit" "kg / m s^2" "si-value" 965843683201.9148 } "c12" { "source-value" 1179.246776622993 "source-unit" "GPa" "source-std-uncert-value" 0.005187286363184856 "si-unit" "kg / m s^2" "si-value" 1179246776622.993 } "c44" { "source-value" 1180.547069723445 "source-unit" "GPa" "source-std-uncert-value" 0.001833982683125036 "si-unit" "kg / m s^2" "si-value" 1180547069723.445 } "excess" { "source-value" 0.6332081910662616 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913659 "si-unit" "kg / m s^2" "si-value" 633208191.0662615 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Zr" "Zr" ] } "a" { "source-value" 3.852408058941365 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.852408058941365e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 1108.1124121493 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579766555 "si-unit" "kg / m s^2" "si-value" 1108112412149.3 } } ]