[ { "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" [ "Es" "Es" ] } "a" { "source-value" 3.632270462810993 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.632270462810993e-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" 234.48195175277394 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725190102 "si-unit" "kg / m s^2" "si-value" 234481951752.7739 } "c12" { "source-value" 286.2907221347338 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863621563415 "si-unit" "kg / m s^2" "si-value" 286290722134.7338 } "c44" { "source-value" 286.6063997379026 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826816688924 "si-unit" "kg / m s^2" "si-value" 286606399737.9026 } "excess" { "source-value" 0.15372662950008073 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913383 "si-unit" "kg / m s^2" "si-value" 153726629.5000807 } } { "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" [ "Es" "Es" ] } "a" { "source-value" 3.632270462810993 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.632270462810993e-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" 269.0211320074138 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015789774335 "si-unit" "kg / m s^2" "si-value" 269021132007.4138 } } ]