[ { "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" [ "O" "O" "O" "O" ] } "a" { "source-value" 3.432517379522324 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.432517379522324e-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" 185.72161150254672 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307251106756 "si-unit" "kg / m s^2" "si-value" 185721611502.5467 } "c12" { "source-value" 40.88403894839085 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361873679 "si-unit" "kg / m s^2" "si-value" 40884038948.39085 } "c44" { "source-value" 39.9495870167054 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812671122 "si-unit" "kg / m s^2" "si-value" 39949587016.7054 } "excess" { "source-value" 0.466863803912653 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809135633 "si-unit" "kg / m s^2" "si-value" 466863803.912653 } } { "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" [ "O" "O" "O" "O" ] } "a" { "source-value" 3.432517379522324 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.432517379522324e-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" 89.16322979977613 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578808286 "si-unit" "kg / m s^2" "si-value" 89163229799.77614 } } ]