[ { "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" 3.82914986461401 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.82914986461401e-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" 1564.6562024214593 "source-unit" "GPa" "source-std-uncert-value" 0.007335930727356826 "si-unit" "kg / m s^2" "si-value" 1564656202421.459 } "c12" { "source-value" 1505.3731002306133 "source-unit" "GPa" "source-std-uncert-value" 0.005187286363560491 "si-unit" "kg / m s^2" "si-value" 1505373100230.613 } "c44" { "source-value" 27.006643824532762 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681246029 "si-unit" "kg / m s^2" "si-value" 27006643824.53276 } "excess" { "source-value" 0.04333216629960179 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913319 "si-unit" "kg / m s^2" "si-value" 43332166.29960179 } } { "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" 3.82914986461401 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.82914986461401e-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" 1525.1341342942287 "source-unit" "GPa" "source-std-uncert-value" 0.004235401580158742 "si-unit" "kg / m s^2" "si-value" 1525134134294.229 } } ]