[ { "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" [ "Sn" "Sn" "Sn" "Sn" ] } "a" { "source-value" 4.633653342723847 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.633653342723848e-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" 101.85884977374701 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072497407 "si-unit" "kg / m s^2" "si-value" 101858849773.747 } "c12" { "source-value" 50.893017678366284 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361885208 "si-unit" "kg / m s^2" "si-value" 50893017678.36629 } "c44" { "source-value" 96.32898482942181 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813589487 "si-unit" "kg / m s^2" "si-value" 96328984829.42181 } "excess" { "source-value" 1.2466324269177088e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 12466.32426917709 } } { "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" [ "Sn" "Sn" "Sn" "Sn" ] } "a" { "source-value" 4.633653342723847 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.633653342723848e-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" 67.88162837682651 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578788271 "si-unit" "kg / m s^2" "si-value" 67881628376.82652 } } ]