[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_tI24_141_2e_e" } "stoichiometric-species" { "source-value" [ "Al" "Ti" ] } "a" { "source-value" 3.8701 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.8701e-10 } "binding-potential-energy-per-atom" { "source-value" -4.14898651908363 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.647409255656787e-19 } "binding-potential-energy-per-formula" { "source-value" -12.44695955725089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.994222776697036e-18 } "parameter-names" { "source-value" [ "c/a" "z1" "z2" "z3" ] } "parameter-values" { "source-value" [ 6.3142813 0.1261866 0.29141139 0.95404089 ] } "library-prototype-label" { "source-value" "A2B_tI24_141_2e_e-001" } "short-name" { "source-value" "Ga2Hf" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B_tI24_141_2e_e" } "stoichiometric-species" { "source-value" [ "Al" "Ti" ] } "a" { "source-value" 3.8701 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.8701e-10 } "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 } "parameter-names" { "source-value" [ "c/a" "z1" "z2" "z3" ] } "parameter-values" { "source-value" [ 6.3142813 0.1261866 0.29141139 0.95404089 ] } "library-prototype-label" { "source-value" "A2B_tI24_141_2e_e-001" } "short-name" { "source-value" "Ga2Hf" } } ]