The inaugural ONETEP Summer School was held in Cambridge
Tuesday 8th July
- 13.30 Lecture 1: Overview of first principles calculations (Mike Payne)
- 14.30 Lecture 2: Introduction to ONETEP (Peter Haynes) PDF
- 15.30 Coffee
- 16.00 Practical session 1 PDF
Wednesday 9th July
- 09.00 Lecture 3: Density matrices (Peter Haynes)
- 10.00 Lecture 4: Psinc functions and FFT boxes (Arash Mostofi) PDF
- 11.00 Coffee
- 11.30 Lecture 5: Electronic energy minimisation (Chris Skylaris) PDF
- 12.30 Lunch
- 13.30 Practical session 2 PDF
- 15.00 Practical session 3 PDF
- 16.00 Coffee
- 16.30 Lecture 6: ONETEP parallelisation (Nick Hine) PDF
- 19.00 Dinner
Thursday 10th July
- 09.00 Lecture 7: Forces and geometry optimisation (Arash Mostofi)
- 10.00 Lecture 8: Overview of ONETEP applications (Chris Skylaris, David O’Regan, Mark Robinson, Quintin Hill and Phil Avraam)
- 11.00 Coffee
- 11.30 General discussion of future plans for ONETEP and creating a user community (Chris Skylaris)
- 12.30 Close
