Spectroscopic studies of neutral and ionic diatomic systems and of molecular react...
Diatomic dications containing transition metals: electronic structure, spectroscop...
Reactivity, transformation, fixation, and spectroscopy of systems involving CO2
Theoretical study of molecules in astrophysical environments
Computational study of bonding and chemical interactions in complexes formed by ox...
Ab initio evolutionary crystal structure prediction of transition metal tellurides...