[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "AB4C_tI24_141_a_h_b" } "stoichiometric-species" { "source-value" [ "Ce" "O" "Si" ] } "a" { "source-value" 7.1196 "source-unit" "angstrom" "si-unit" "m" "si-value" 7.1196e-10 } "binding-potential-energy-per-atom" { "source-value" -6.641457769861323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.064078845456956e-18 } "binding-potential-energy-per-formula" { "source-value" -39.84874661916794 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.384473072741736e-18 } "parameter-names" { "source-value" [ "c/a" "y3" "z3" ] } "parameter-values" { "source-value" [ 0.91245295 0.072668755 0.21897872 ] } "library-prototype-label" { "source-value" "A4BC_tI24_141_h_b_a-001" } "short-name" { "source-value" "Zircon" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "AB4C_tI24_141_a_h_b" } "stoichiometric-species" { "source-value" [ "Ce" "O" "Si" ] } "a" { "source-value" 7.1196 "source-unit" "angstrom" "si-unit" "m" "si-value" 7.1196e-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" "y3" "z3" ] } "parameter-values" { "source-value" [ 0.91245295 0.072668755 0.21897872 ] } "library-prototype-label" { "source-value" "A4BC_tI24_141_h_b_a-001" } "short-name" { "source-value" "Zircon" } } ]