DFT tutorials

I made some DFT tutorials below. The tutorials are contained in the PDF files. Some YouTube videos are made to explain these tutorials. If you have any comments or suggestions, just email me: chuang3@fsu.edu

Tutorial 1: Bulk modulus of diamond (PDF, video )


Tutorial 2: Shear modulus of diamond (PDF, video)


Tutorial 3: Phase transition pressure of silicon from diamond structure to beta-tin structure (PDF, video)

Tutorial 4: Torsion potential (PDF, video)

Tutorial 5: Band structure and density of states of aluminum (PDF, video)

Tutorial 6: Band structure and Dirac cone of graphene (PDF, video)

Tutorial 7: Peierls transition of a hydrogen chain

(PDF, video)

Tutorial 8: Vacancy formation energy

(PDF, video)