[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A12B17_cI58_217_g_acg" } "stoichiometric-species" { "source-value" [ "Al" "Mg" ] } "a" { "source-value" 10.5596 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.05596e-09 } "parameter-names" { "source-value" [ "x2" "x3" "z3" "x4" "z4" ] } "parameter-values" { "source-value" [ 0.17615175 0.090073683 0.72246539 0.35764095 0.95993764 ] } "binding-potential-energy-per-atom" { "source-value" -2.317061875716774 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.712342396805627e-19 } "binding-potential-energy-per-formula" { "source-value" -67.19479439578645 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.076579295073632e-17 } "coordinates-file" { "source-value" "instance-1.poscar" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A12B17_cI58_217_g_acg" } "stoichiometric-species" { "source-value" [ "Al" "Mg" ] } "a" { "source-value" 10.5596 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.05596e-09 } "parameter-names" { "source-value" [ "x2" "x3" "z3" "x4" "z4" ] } "parameter-values" { "source-value" [ 0.17615175 0.090073683 0.72246539 0.35764095 0.95993764 ] } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "temperature" { "source-value" 0.0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "coordinates-file" { "source-value" "instance-2.poscar" } } ]