[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Se" "Se" ] } "a" { "source-value" 3.66631294041872 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.66631294041872e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 80.53501619603644 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724939337 "si-unit" "kg / m s^2" "si-value" 80535016196.03644 } "c12" { "source-value" 104.8156627471754 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361947316 "si-unit" "kg / m s^2" "si-value" 104815662747.1754 } "c44" { "source-value" 5.7366209972703155 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812113823 "si-unit" "kg / m s^2" "si-value" 5736620997.270315 } "excess" { "source-value" 1.6653345369381015e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 1.665334536938101 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Se" "Se" ] } "a" { "source-value" 3.66631294041872 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.66631294041872e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 96.72211389679575 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578815395 "si-unit" "kg / m s^2" "si-value" 96722113896.79575 } } ]