[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "W" "W" "W" "W" ] } "a" { "source-value" 3.792585492134094 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.792585492134094e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-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" 626.3073289362312 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725828347 "si-unit" "kg / m s^2" "si-value" 626307328936.2312 } "c12" { "source-value" 494.7477374167543 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362396444 "si-unit" "kg / m s^2" "si-value" 494747737416.7543 } "c44" { "source-value" 478.2660153978674 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826819810871 "si-unit" "kg / m s^2" "si-value" 478266015397.8674 } "excess" { "source-value" 0.253815257700352 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809134406 "si-unit" "kg / m s^2" "si-value" 253815257.700352 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "W" "W" "W" "W" ] } "a" { "source-value" 3.792585492134094 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.792585492134094e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-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" 538.6009345899133 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579230959 "si-unit" "kg / m s^2" "si-value" 538600934589.9133 } } ]