[ { "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" [ "Fe" "Fe" ] } "a" { "source-value" 2.8665000349283223 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866500034928322e-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" 241.11258082317124 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725200901 "si-unit" "kg / m s^2" "si-value" 241112580823.1712 } "c12" { "source-value" 146.84556228124197 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361995727 "si-unit" "kg / m s^2" "si-value" 146845562281.242 } "c44" { "source-value" 114.28710491537008 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813882007 "si-unit" "kg / m s^2" "si-value" 114287104915.3701 } "excess" { "source-value" 0.11871671290466906 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913363 "si-unit" "kg / m s^2" "si-value" 118716712.9046691 } } { "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" [ "Fe" "Fe" ] } "a" { "source-value" 2.8665000349283223 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.866500034928322e-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" 178.26790179521836 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578892084 "si-unit" "kg / m s^2" "si-value" 178267901795.2184 } } ]