[ { "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" 2.859877958893776 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.859877958893776e-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" 222.95253268827446 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725171319 "si-unit" "kg / m s^2" "si-value" 222952532688.2744 } "c12" { "source-value" 145.42464408036327 "source-unit" "GPa" "source-std-uncert-value" 0.00518728636199409 "si-unit" "kg / m s^2" "si-value" 145424644080.3633 } "c44" { "source-value" 117.90663172401487 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813940968 "si-unit" "kg / m s^2" "si-value" 117906631724.0149 } "excess" { "source-value" 5.181040781585205e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 5.181040781585205 } } { "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" 2.859877958893776 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.859877958893776e-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" 171.26727361633363 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578885501 "si-unit" "kg / m s^2" "si-value" 171267273616.3336 } } ]