[ { "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" [ "W" "W" ] } "a" { "source-value" 3.1638794839382167 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.163879483938217e-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" 532.5970742784835 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307256757 "si-unit" "kg / m s^2" "si-value" 532597074278.4835 } "c12" { "source-value" 204.9617276031745 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863620626665 "si-unit" "kg / m s^2" "si-value" 204961727603.1745 } "c44" { "source-value" 163.41900758095133 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814682317 "si-unit" "kg / m s^2" "si-value" 163419007580.9513 } "excess" { "source-value" 0.14890423323998392 "source-unit" "GPa" "source-std-uncert-value" 0.00259364318091338 "si-unit" "kg / m s^2" "si-value" 148904233.2399839 } } { "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" [ "W" "W" ] } "a" { "source-value" 3.1638794839382167 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.163879483938217e-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" 314.1735098282775 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579019897 "si-unit" "kg / m s^2" "si-value" 314173509828.2775 } } ]