Topics to be covered:
Theory Lectures:
- Density Functional Theory (DFT), Exchange correlation functional, Pseudopotentials
- DFT implementation with different basis sets
- Quasi-particles and GW
- Model Hamiltonian
- Novel algorithms and frameworks for materials simulation
- Machine learning and DFT
Tutorial Session: Quantum Espresso
Experimental Lecture in line with the theory Lectures:
- Electron spectroscopy: ARPES
- Scanning Tunneling Microscopy
- Surfaces, interfaces and heterojunctions
- Probing quantum structures
Applications of Emerging Materials:
- Energy Materials
- Functional Materials
- Spintronics Materials
- 2D Materials
- Topological Materials
- Strongly Correlated Materials
- Quantum Materials