[ { "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" [ "Pd" "Pd" ] } "a" { "source-value" 3.089509047567844 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.089509047567844e-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" 771.5338060688541 "source-unit" "GPa" "source-std-uncert-value" 0.007335930726064907 "si-unit" "kg / m s^2" "si-value" 771533806068.8541 } "c12" { "source-value" 785.8282768125309 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362731712 "si-unit" "kg / m s^2" "si-value" 785828276812.5309 } "c44" { "source-value" 439.08353832176846 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826819172627 "si-unit" "kg / m s^2" "si-value" 439083538321.7684 } "excess" { "source-value" 0.10251125178349585 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133534 "si-unit" "kg / m s^2" "si-value" 102511251.7834958 } } { "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" [ "Pd" "Pd" ] } "a" { "source-value" 3.089509047567844 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.089509047567844e-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" 781.0634532313053 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579458982 "si-unit" "kg / m s^2" "si-value" 781063453231.3053 } } ]