[ { "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" 3.52422046661377 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52422046661377e-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" 262.2972940181123 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725235408 "si-unit" "kg / m s^2" "si-value" 262297294018.1123 } "c12" { "source-value" 151.14693416273434 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863620006805 "si-unit" "kg / m s^2" "si-value" 151146934162.7343 } "c44" { "source-value" 132.50644885068473 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814178786 "si-unit" "kg / m s^2" "si-value" 132506448850.6847 } "excess" { "source-value" 0.12588815501149428 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913367 "si-unit" "kg / m s^2" "si-value" 125888155.0114943 } } { "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" 3.52422046661377 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52422046661377e-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" 188.197054114527 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578901421 "si-unit" "kg / m s^2" "si-value" 188197054114.527 } } ]