Electronic structure calculations based on the one particle Green's function and DFT
Title: |
Electronic structure calculations based on the one particle Green's function and DFT |
DNr: |
SNIC 2022/22-784 |
Project Type: |
SNIC Small Compute |
Principal Investigator: |
Thijs Jan Holleboom <thijs.holleboom@kau.se> |
Affiliation: |
Karlstads universitet |
Duration: |
2022-09-01 – 2023-09-01 |
Classification: |
10304 |
Keywords: |
|
Abstract
Different approximations for calculating the one particle Green's function, following a DFT calculation, will be tested for medium sized finite systems, both surfaces and bulk systems.