Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1561960 | Computational Materials Science | 2012 | 6 Pages |
Abstract
⺠Assesses reliability of Tran-Blaha potential for describing bulk germanium (Ge). ⺠Shows this new approach gives results as good as state-of-the-art GW calculations. ⺠Confirms potential of this approach for studying Ge surfaces and nanostructures. ⺠Opens the way for fast and accurate calculations of the properties of bulk Ge. ⺠Provides impetus for applications to other systems needing accurate bandstructures.
Related Topics
Physical Sciences and Engineering
Engineering
Computational Mechanics
Authors
P.V. Smith, M. Hermanowicz, G.A. Shah, M.W. Radny,