[ { "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" 3.521521747112274 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.521521747112274e-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" 282.91357902201804 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307252689925 "si-unit" "kg / m s^2" "si-value" 282913579022.0181 } "c12" { "source-value" 168.26681685111484 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362020401 "si-unit" "kg / m s^2" "si-value" 168266816851.1148 } "c44" { "source-value" 129.28353184925837 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814126284 "si-unit" "kg / m s^2" "si-value" 129283531849.2584 } "excess" { "source-value" 0.00025666757608183813 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 256667.5760818381 } } { "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" 3.521521747112274 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.521521747112274e-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" 206.4824042414159 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578918619 "si-unit" "kg / m s^2" "si-value" 206482404241.4159 } } ]