Energy-oriented Center of Excellence (EoCoE) Summer School

Session

MATERIALS

ses-material

Jun 7, 2022, 9:00 AM

Online

Description

[session-stream] https://us06web.zoom.us/j/86418557171?pwd=SlVVa2xHbEJwdGpUbmpWYnpuaXMrdz09 [/session-stream]

Presentation materials

DFTB+ tutorial

4. Introduction

Dr Alessandro Pecchia (Consiglio Nazionale delle Ricerche)

6/7/22, 9:00 AM

Introduction to the density functional tight-binding approach (DFTB) and transport calculations

5. Graphene electronic bands

Alessandro Pecchia (Consiglio Nazionale delle Ricerche)

6/7/22, 9:45 AM

Calculation of the electronic bands in graphene

6. Graphene nanoribbons

Alessandro Pecchia (Consiglio Nazionale delle Ricerche)

6/7/22, 10:15 AM

Graphene nanoribbons with a vacancy defect

7. Setup and transport

Alessandro Pecchia (Consiglio Nazionale delle Ricerche)

6/7/22, 11:00 AM

Setup and transport calculations

8. Si/aSi/Si

Alessandro Pecchia (Consiglio Nazionale delle Ricerche)

6/7/22, 11:45 AM

Another example: Si/aSi/Si interface

9. Conclusion

Alessandro Pecchia (Consiglio Nazionale delle Ricerche)

6/7/22, 12:15 PM

Time for summary, QA, ideas.