How to tune the Ru-NO coordination bond: insight from Kohn-Sham molecular orbital ...
Reactivity and Aromaticity: a Kohn-Sham Molecular Orbital Perspective.
Probing the Kinetic Trans Effect in Halide Ion Substitution Reactions of Dinuclear...
Study of nitrate compounds - 195Pt (IV) in solution by ab initio molecular dynamic...
How modulate the Ruthenium-NO chemical bond from ligands of different nature?
Elucidation of the bonding mechanism in processes of anion recognition
The use of quantum-mechanical methods to study the bonds and chemical interactions...