[ { "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" 3.5199998259544394 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.51999982595444e-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" 233.2719679844826 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725188129 "si-unit" "kg / m s^2" "si-value" 233271967984.4826 } "c12" { "source-value" 154.28812933515312 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362004299 "si-unit" "kg / m s^2" "si-value" 154288129335.1531 } "c44" { "source-value" 127.85415363642937 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814103002 "si-unit" "kg / m s^2" "si-value" 127854153636.4294 } "excess" { "source-value" 0.10644322312460942 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133556 "si-unit" "kg / m s^2" "si-value" 106443223.1246094 } } { "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" 3.5199998259544394 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.51999982595444e-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" 180.61607555159628 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015788942925 "si-unit" "kg / m s^2" "si-value" 180616075551.5963 } } ]