[ { "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" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" 3.982406347990036 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.982406347990036e-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" 609.472083787463 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725800923 "si-unit" "kg / m s^2" "si-value" 609472083787.463 } "c12" { "source-value" 13.648026660820443 "source-unit" "GPa" "source-std-uncert-value" 0.00518728636184231 "si-unit" "kg / m s^2" "si-value" 13648026660.82044 } "c44" { "source-value" 190.1648599856173 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826815117982 "si-unit" "kg / m s^2" "si-value" 190164859985.6173 } "excess" { "source-value" 2.2224000417741426e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 22224.00041774143 } } { "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" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" 3.982406347990036 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.982406347990036e-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" 212.25604570303463 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578924049 "si-unit" "kg / m s^2" "si-value" 212256045703.0346 } } ]