[ { "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" [ "Ga" "Ga" "Ga" "Ga" ] } "a" { "source-value" 3.971089385449887 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.971089385449888e-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" 1515.8133477670337 "source-unit" "GPa" "source-std-uncert-value" 0.007335930727277265 "si-unit" "kg / m s^2" "si-value" 1515813347767.034 } "c12" { "source-value" 1643.163529245235 "source-unit" "GPa" "source-std-uncert-value" 0.005187286363719199 "si-unit" "kg / m s^2" "si-value" 1643163529245.235 } "c44" { "source-value" 73.05114632814154 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813210316 "si-unit" "kg / m s^2" "si-value" 73051146328.14154 } "excess" { "source-value" 0.0002311562052881809 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 231156.2052881809 } } { "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" [ "Ga" "Ga" "Ga" "Ga" ] } "a" { "source-value" 3.971089385449887 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.971089385449888e-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" 1600.7134687525013 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015802298205 "si-unit" "kg / m s^2" "si-value" 1600713468752.501 } } ]