[ { "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" [ "Ca" "Ca" ] } "a" { "source-value" 3.874411970376968 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.874411970376968e-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" 41.276463872206506 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724875387 "si-unit" "kg / m s^2" "si-value" 41276463872.2065 } "c12" { "source-value" 50.396496917193275 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361884637 "si-unit" "kg / m s^2" "si-value" 50396496917.19328 } "c44" { "source-value" 50.45206684740623 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812842196 "si-unit" "kg / m s^2" "si-value" 50452066847.40623 } "excess" { "source-value" 0.02706089515433167 "source-unit" "GPa" "source-std-uncert-value" 0.00259364318091331 "si-unit" "kg / m s^2" "si-value" 27060895.15433167 } } { "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" [ "Ca" "Ca" ] } "a" { "source-value" 3.874411970376968 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.874411970376968e-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" 47.35648590219768 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578768969 "si-unit" "kg / m s^2" "si-value" 47356485902.19769 } } ]