Theoretical Chemistry NV1
Syllabus, C-level, 1KE340
This course has been discontinued.
- Code
- 1KE340
- Level
- C
- Subject(s)
- Physics
- Grading system
- Pass with distinction (VG), Pass (G), Fail (U)
- Finalised
- 29 January 2005
- Responsible department
- Department of Chemistry for Life Sciences
Entry requirements
Two years of University studies. 20 credit points mathematics and 40 credit points physics or chemistry
Aims
The aim of the course is to give deeper knowledge about quantum mechanical treatment of many-electron systems, and to give familiarity with different computational methods for quantum chemical calculations on molecular systems.
Content
Quantum Mechanics: wave functions, operators,
the Schrödinger equation, 1-dim models, angular momentum
perturbation theory, the variational principle.
Molecular Physics: the Hydrogen atom, independent particle model,
the Hartree-Fock approximation. Molecular orbital theory.
Valence bond. Density functional theory. Symmetri.
Theoretical Chemistry: Computational methods in Quantum Cehmistry,
Instruction
Lectures, lessons and computer exercises
Assessment
Witten examination at the end of the different
parts of the course. Oral presentationm of project work.
Reading list
No reading list found.