| Detailed information |
| Original study plan |
Master's programme Physics 2023W |
| Objectives |
Learning of competences in the quantum mechanical description of molecules and concepts for the quantitative description of molecular properties using analytical and numerical approaches.
|
| Subject |
Introduction to the quantum mechanics of molecules; description of the electronic structure using wave-function based approaches (Hartree-Fock and extensions) and in the frame work of density functional theory; Slater determinants; variational principle; ground and excited states of molecules and periodic systems; coupled dynamics of nuclei and electrons; chemical reactions.
|
| Criteria for evaluation |
written and/or oral exams
|
| Methods |
lecture
|
| Study material |
as announced in the course
|
| Changing subject? |
No |
| Further information |
course language may be changed to english if requested
|
| Earlier variants |
They also cover the requirements of the curriculum (from - to)
461WTPHTQCV20: VL Theoretical Quantum Chemistry (2020W-2023S)
|
