[ { "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" 3.053088620305061 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.053088620305061e-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" 6795.82287392727 "source-unit" "GPa" "source-std-uncert-value" 0.007335930735877895 "si-unit" "kg / m s^2" "si-value" 6795822873927.27 } "c12" { "source-value" 3877.316071065121 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863662925164 "si-unit" "kg / m s^2" "si-value" 3877316071065.121 } "c44" { "source-value" 3885.374843907057 "source-unit" "GPa" "source-std-uncert-value" 0.00183398268753094 "si-unit" "kg / m s^2" "si-value" 3885374843907.057 } "excess" { "source-value" 3.8559094785274284 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180915515 "si-unit" "kg / m s^2" "si-value" 3855909478.527428 } } { "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" 3.053088620305061 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.053088620305061e-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" 4850.15167201917 "source-unit" "GPa" "source-std-uncert-value" 0.004235401583285749 "si-unit" "kg / m s^2" "si-value" 4850151672019.17 } } ]