We theoretically characterize interactions, energetics, and chemical reaction paths in ionic
two-body and three-body systems of alkali-metal and alkaline-earth-metal atoms in the …

The adiabatic potential energy curves and the permanent and transition dipole moments of
the low-lying electronic states of the NaLi molecule dissociating into Na (3s, 3p, 4s, 3d, 4p)+ …

Despite the success of the molecular orbital (MO) and valence-bond (VB) models to
describe the electronic structure and properties of molecules, neither MO nor VB provides an …

For nearly all the states dissociating into Cs (6s, 6p, 5d, 7s, 7p, 6d, 8s) and Li (2s, 2p, 3s), we
present an extensive adiabatic study for 1, 3Σ+, 1, 3Π, and 1, 3Δ symmetries of the LiCs …

This paper presents an extensive ab initio investigation of the electronic properties and
elastic collisions of charged diatomic systems FrLi+ and FrNa+. We employ an accurate ab …

The adiabatic potential energy, the spectroscopic constants and the transition dipole
moments of the lowest electronic states of the LiK+ molecule, dissociating into Li (2s, 2p, 3s …

The potential energy curves and the spectroscopic constants of the electronic states of 2Σg,
u+, 2Πg, u and 2Δg, u symmetries of Li2+ ionic system dissociating into Li (2s, 2p, 3s, 3p, 3d …

Adiabatic and diabatic potential energy curves and the permanent and transition dipole
moments of the low-lying electronic states of the LiRb molecule dissociating into Rb (5s, 5p …

The electronic structure and the spectroscopic constants of the low lying electronic states of
the NaK+ ionic molecule have been determined through using an ab initio approach …

The electronic structure and the spectroscopic properties for low‐lying electronic states of
the LiRb+ molecular ion, dissociating into Li (2s, 2p, 3s, 3p, 3d, 4s, and 4p)+ Rb+ and Li++ …