[ { "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" [ "Zn" "Zn" "Zn" "Zn" ] } "a" { "source-value" 4.03512442111969 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.03512442111969e-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" 110.19288864402495 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724987646 "si-unit" "kg / m s^2" "si-value" 110192888644.0249 } "c12" { "source-value" 37.79279401813681 "source-unit" "GPa" "source-std-uncert-value" 0.00518728636187012 "si-unit" "kg / m s^2" "si-value" 37792794018.13681 } "c44" { "source-value" 59.947966005552665 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812996875 "si-unit" "kg / m s^2" "si-value" 59947966005.55267 } "excess" { "source-value" 2.035408878479902e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 2.035408878479902 } } { "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" [ "Zn" "Zn" "Zn" "Zn" ] } "a" { "source-value" 4.03512442111969 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.03512442111969e-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" 61.926158893432856 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578782672 "si-unit" "kg / m s^2" "si-value" 61926158893.43285 } } ]