[ { "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" 3.7290542796254162 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.729054279625416e-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" 531.0255343402999 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725673142 "si-unit" "kg / m s^2" "si-value" 531025534340.2999 } "c12" { "source-value" 512.062488187398 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362416388 "si-unit" "kg / m s^2" "si-value" 512062488187.398 } "c44" { "source-value" 102.4739038080428 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813689583 "si-unit" "kg / m s^2" "si-value" 102473903808.0428 } "excess" { "source-value" 2.6334934233324364e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 26334.93423332436 } } { "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" 3.7290542796254162 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.729054279625416e-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" 518.3835035716986 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579211946 "si-unit" "kg / m s^2" "si-value" 518383503571.6986 } } ]