Advanced Topics in Quantum Chemistry

Period of duration of course
Course info
Number of course hours
Number of hours of lecturers of reference
Number of hours of supplementary teaching

Modalità esame

Oral exam and seminars


Quantum Mechanics and fundamentals of theoretical chemistry. IV and V year and PhD students.


The aim of the course is to discuss the quantum-mechanical fundamentals of intermolecular interactions, and the main QM methods exploited to partition the
interaction energy in the different energetic contributions: electrostatics, polarization, exchange, repulsion, dispersion, and charge-transfer. The course will
provide the students with the theoretical and computational skills to evaluate the accuracy of the different methods. Some aspects will be highlighted with hands-on sessions targeting real-case scenarios.

Obiettivi formativi

The students will understand the physico-chemical fundamentals of intermolecular interactions and the approximations of the different computational approaches to partition the interaction energy.

Riferimenti bibliografici

Bibliography will be indicated to the enrolled students.