Modeling the electronic structures of the ground and excited states of the ytterbium atom and the ytterbium dimer: A modern quantum chemistry perspective

Paweł Tecmer, Katharina Boguslawski, Mateusz Borkowski +2

We present a comprehensive theoretical study of the electronic structures of the Yb atom and the Yb${}_2$ molecule, respectively, focusing on their ground and lowest-lying electronic…