[ { "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" [ "Br" "Br" ] } "a" { "source-value" 2.64165123552084 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.64165123552084e-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" 1934.177704011072 "source-unit" "GPa" "source-std-uncert-value" 0.007335930727958743 "si-unit" "kg / m s^2" "si-value" 1934177704011.072 } "c12" { "source-value" 2361.5341535366474 "source-unit" "GPa" "source-std-uncert-value" 0.005187286364546626 "si-unit" "kg / m s^2" "si-value" 2361534153536.647 } "c44" { "source-value" 2364.1380989337313 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826850529918 "si-unit" "kg / m s^2" "si-value" 2364138098933.731 } "excess" { "source-value" 1.2680490151242858 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809140247 "si-unit" "kg / m s^2" "si-value" 1268049015.124286 } } { "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" [ "Br" "Br" ] } "a" { "source-value" 2.64165123552084 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.64165123552084e-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" 2219.082003694789 "source-unit" "GPa" "source-std-uncert-value" 0.004235401580811365 "si-unit" "kg / m s^2" "si-value" 2219082003694.789 } } ]