[ { "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" 3.5200000256299973 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000025629997e-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" 241.31929064102647 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307252012385 "si-unit" "kg / m s^2" "si-value" 241319290641.0265 } "c12" { "source-value" 150.8065906653495 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362000288 "si-unit" "kg / m s^2" "si-value" 150806590665.3495 } "c44" { "source-value" 127.75794721582156 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814101434 "si-unit" "kg / m s^2" "si-value" 127757947215.8216 } "excess" { "source-value" 0.20683111253328745 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809134132 "si-unit" "kg / m s^2" "si-value" 206831112.5332875 } } { "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" 3.5200000256299973 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.520000025629997e-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" 180.97749065724182 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015788946325 "si-unit" "kg / m s^2" "si-value" 180977490657.2418 } } ]