[ { "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" [ "Fr" "Fr" ] } "a" { "source-value" 5.723565325140958 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.723565325140959e-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" 36.18456412539718 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307248670935 "si-unit" "kg / m s^2" "si-value" 36184564125.39718 } "c12" { "source-value" 44.17954142766774 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361877476 "si-unit" "kg / m s^2" "si-value" 44179541427.66774 } "c44" { "source-value" 44.22825599279028 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812740817 "si-unit" "kg / m s^2" "si-value" 44228255992.79028 } "excess" { "source-value" 0.023722640185580245 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913308 "si-unit" "kg / m s^2" "si-value" 23722640.18558025 } } { "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" [ "Fr" "Fr" ] } "a" { "source-value" 5.723565325140958 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.723565325140959e-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" 41.51454899357755 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578763476 "si-unit" "kg / m s^2" "si-value" 41514548993.57755 } } ]