[ { "short-name" { "source-value" [ "sc" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" 4.25433506072e-10 "source-value" 4.25433506072 } "temperature" { "si-unit" "K" "source-unit" "K" "si-value" 0.0 "source-value" 0 } "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "c44" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" -460082377.31 "source-std-uncert-value" 0.0018339826812027872 "source-value" -0.4600823773095171 } "space-group" { "source-value" "Pm-3m" } "excess" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 0.00462592926927 "source-std-uncert-value" 0.0025936431809132944 "source-value" 4.625929269272505e-12 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] ] } "c12" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" -390308724.84 "source-std-uncert-value" 0.005187286361827039 "source-value" -0.39030872484033524 } "c11" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 6280789400.75 "source-std-uncert-value" 0.007335930724818384 "source-value" 6.280789400751881 } "cauchy-stress" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-value" [ 0 0 0 0 0 0 ] } "species" { "source-value" [ "Xe" ] } "instance-id" 1 } { "short-name" { "source-value" [ "sc" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" 4.25433506072e-10 "source-value" 4.25433506072 } "temperature" { "si-unit" "K" "source-unit" "K" "si-value" 0.0 "source-value" 0 } "isothermal-bulk-modulus" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 1833390650.36 "source-std-uncert-value" 0.004235401578726647 "source-value" 1.83339065035707 } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "space-group" { "source-value" "Pm-3m" } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] ] } "cauchy-stress" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-value" [ 0 0 0 0 0 0 ] } "species" { "source-value" [ "Xe" ] } "instance-id" 2 } ]