[ { "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" [ "V" "V" ] } "a" { "source-value" 3.031088910996914 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.031088910996914e-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" 232.30553631023932 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725186556 "si-unit" "kg / m s^2" "si-value" 232305536310.2393 } "c12" { "source-value" 119.36757268496264 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361964077 "si-unit" "kg / m s^2" "si-value" 119367572684.9626 } "c44" { "source-value" 46.101033031349175 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681277132 "si-unit" "kg / m s^2" "si-value" 46101033031.34917 } "excess" { "source-value" 0.04379562475639904 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133196 "si-unit" "kg / m s^2" "si-value" 43795624.75639904 } } { "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" [ "V" "V" ] } "a" { "source-value" 3.031088910996914 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.031088910996914e-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" 157.01356056005486 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578872096 "si-unit" "kg / m s^2" "si-value" 157013560560.0549 } } ]