Abstract
The ground 1Σ g +, the lowest 1,3Π, 1,3Δ and 1,3Σ − excited states of the AsN molecule have been calculated using a double-zeta + polarization + diffuse basis set, large CI and non-empirical pseudopotentials. Agreement with experimental r c, ω c and transition energies is good. The calculated D c is 4.22 eV. The 1,3Σ − states are confirmed to be the perturbers of the 1,3Π states.
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