[ { "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" [ "Se" "Se" "Se" "Se" ] } "a" { "source-value" 4.0104364454746255 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.010436445474626e-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" 1780.1804579199295 "source-unit" "GPa" "source-std-uncert-value" 0.007335930727707895 "si-unit" "kg / m s^2" "si-value" 1780180457919.929 } "c12" { "source-value" 66.70763731858216 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361903425 "si-unit" "kg / m s^2" "si-value" 66707637318.58216 } "c44" { "source-value" 15.212336113460422 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812268174 "si-unit" "kg / m s^2" "si-value" 15212336113.46042 } "excess" { "source-value" 0.3482014159969357 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913495 "si-unit" "kg / m s^2" "si-value" 348201415.9969357 } } { "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" [ "Se" "Se" "Se" "Se" ] } "a" { "source-value" 4.0104364454746255 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.010436445474626e-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" 637.865244185698 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579324313 "si-unit" "kg / m s^2" "si-value" 637865244185.698 } } ]