[ { "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" 241.3542175219695 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725201296 "si-unit" "kg / m s^2" "si-value" 241354217521.9695 } "c12" { "source-value" 150.83719807884208 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362000324 "si-unit" "kg / m s^2" "si-value" 150837198078.8421 } "c44" { "source-value" 127.76058665293488 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814101476 "si-unit" "kg / m s^2" "si-value" 127760586652.9349 } "excess" { "source-value" 0.20683101868243445 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809134132 "si-unit" "kg / m s^2" "si-value" 206831018.6824344 } } { "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" 181.00953789321787 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578894663 "si-unit" "kg / m s^2" "si-value" 181009537893.2179 } } ]