[ { "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" [ "Ni" "Ni" "Ni" "Ni" ] } "a" { "source-value" 3.520000003278256 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000003278256e-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" 247.25210781900603 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725210901 "si-unit" "kg / m s^2" "si-value" 247252107819.006 } "c12" { "source-value" 147.73965906540747 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863619967565 "si-unit" "kg / m s^2" "si-value" 147739659065.4075 } "c44" { "source-value" 125.05008152029647 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814057327 "si-unit" "kg / m s^2" "si-value" 125050081520.2965 } "excess" { "source-value" 5.033011044968485e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 5.033011044968485 } } { "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" [ "Ni" "Ni" "Ni" "Ni" ] } "a" { "source-value" 3.520000003278256 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000003278256e-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" 180.91047531660698 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578894569 "si-unit" "kg / m s^2" "si-value" 180910475316.607 } } ]