Quantum Chemistry (F10011)
Quantum Chemistry
Module F10011
Module details for 2024/25.
15 credits
FHEQ Level 7 (Masters)
Module Outline
This module describes the various theorems, methods and techniques which form the basis of theoretical and computation quantum chemistry. It will start with the foundations and theorems of quantum mechanics, and then will cover operators and matrices in quantum chemistry. The module will introduce techniques of approximation including the variational method and perturbation theory. The solution of the electronic Schrödinger equation under different approximations will then be explored, providing a comprehensive, critical, understanding of computational quantum chemistry methods applicable to chemical research.
Module learning outcomes
Explain and deploy the important techniques of quantum chemistry to current problems.
Solve and analyse theoretical chemistry problems both numerically and analytically.
Demonstrate a knowledge and critical understanding of the principles underlying methods of computational quantum chemistry.
| Type | Timing | Weighting |
|---|---|---|
| Unseen Examination | Semester 2 Assessment | 70.00% |
| Coursework | 30.00% | |
| Coursework components. Weighted as shown below. | ||
| Problem Set | T2 Week 6 | 100.00% |
Timing
Submission deadlines may vary for different types of assignment/groups of students.
Weighting
Coursework components (if listed) total 100% of the overall coursework weighting value.
| Term | Method | Duration | Week pattern |
|---|---|---|---|
| Spring Semester | Lecture | 2 hours | 1111111111 |
| Spring Semester | Workshop | 1 hour | 0111111111 |
How to read the week pattern
The numbers indicate the weeks of the term and how many events take place each week.
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