[ { "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" [ "Au" "Au" ] } "a" { "source-value" 3.186434537172318 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.186434537172318e-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" 114.96437930231377 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724995418 "si-unit" "kg / m s^2" "si-value" 114964379302.3138 } "c12" { "source-value" 216.36250475514422 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362075797 "si-unit" "kg / m s^2" "si-value" 216362504755.1442 } "c44" { "source-value" 89.39128850414191 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813476476 "si-unit" "kg / m s^2" "si-value" 89391288504.1419 } "excess" { "source-value" 0.01091208397715352 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913301 "si-unit" "kg / m s^2" "si-value" 10912083.97715352 } } { "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" [ "Au" "Au" ] } "a" { "source-value" 3.186434537172318 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.186434537172318e-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" 182.5631296042007 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015788961235 "si-unit" "kg / m s^2" "si-value" 182563129604.2007 } } ]