Introduction to Computational Chemistry

Academic year 2025/2026
Lecturer Chiara Cappelli

Examination procedure

<p>Written report and oral exam.</p>

Prerequisites

The course is recommended for the first year of the internal undergraduate program. It is also accessible to external students throughout the three years of the Bachelor's degree. There are no prerequisites for attending the course or taking the exam.

Syllabus

Conceptual introduction to computational methods in chemistry.

Classical vs quantum-mechanical approaches: fundamental concepts.

Search for minimum-energy geometries: conceptual aspects.

Selected examples of the use of computational programs for molecular studies.