Preprint
Perturbation approach to ab initio effective mass calculations
Abstract
A degenerate perturbation $k\cdot p$ approach for effective mass calculations
is implemented in the all-electron density functional theory (DFT) package
Authors
Rubel O; Tran F; Rocquefelte X; Blaha P
Publication date
July 7, 2020
DOI
10.48550/arxiv.2007.03816
Preprint server
arXiv