[ { "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" [ "Mo" "Mo" ] } "a" { "source-value" 3.166686400771141 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.166686400771141e-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" 434.87202668484446 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725516517 "si-unit" "kg / m s^2" "si-value" 434872026684.8445 } "c12" { "source-value" 169.17168409075353 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863620214425 "si-unit" "kg / m s^2" "si-value" 169171684090.7535 } "c44" { "source-value" 95.89253683036902 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813582377 "si-unit" "kg / m s^2" "si-value" 95892536830.36902 } "excess" { "source-value" 0.012130851733539333 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133013 "si-unit" "kg / m s^2" "si-value" 12130851.73353933 } } { "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" [ "Mo" "Mo" ] } "a" { "source-value" 3.166686400771141 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.166686400771141e-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" 257.73846495545047 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578966822 "si-unit" "kg / m s^2" "si-value" 257738464955.4505 } } ]