[ { "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" 3.045244961977005 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.045244961977005e-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" 40988.303296288264 "source-unit" "GPa" "source-std-uncert-value" 0.007335930791574158 "si-unit" "kg / m s^2" "si-value" 40988303296288.27 } "c12" { "source-value" 40283.88487411404 "source-unit" "GPa" "source-std-uncert-value" 0.005187286408225927 "si-unit" "kg / m s^2" "si-value" 40283884874114.04 } "c44" { "source-value" -1047.7536535187326 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826829087283 "si-unit" "kg / m s^2" "si-value" -1047753653518.733 } "excess" { "source-value" 0.31043914846176995 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913473 "si-unit" "kg / m s^2" "si-value" 310439148.4617699 } } { "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" 3.045244961977005 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.045244961977005e-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" 40518.69101483878 "source-unit" "GPa" "source-std-uncert-value" 0.004235401616830158 "si-unit" "kg / m s^2" "si-value" 40518691014838.78 } } ]