[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Si" ] } "a" { "source-value" 2.604630976915359 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.604630976915359e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] ] } "space-group" { "source-value" "Pm-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" 303.3213235035916 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725302232 "si-unit" "kg / m s^2" "si-value" 303321323503.5916 } "c12" { "source-value" 131.03160568664453 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361977512 "si-unit" "kg / m s^2" "si-value" 131031605686.6445 } "c44" { "source-value" 27.808846086188257 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812473362 "si-unit" "kg / m s^2" "si-value" 27808846086.18826 } "excess" { "source-value" 3.996802888651444e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 3.996802888651444 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Si" ] } "a" { "source-value" 2.604630976915359 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.604630976915359e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] ] } "space-group" { "source-value" "Pm-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" 188.46151162562688 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578901671 "si-unit" "kg / m s^2" "si-value" 188461511625.6269 } } ]