Cargando…
Nonadiabatic Electron Dynamics in Tunneling Junctions: Lattice Exchange-Correlation Potential
[Image: see text] The search for exchange-correlation functionals going beyond the adiabatic approximation has always been a challenging task for time-dependent density-functional theory. Starting from known results and using symmetry properties, we put forward a nonadiabatic exchange-correlation fu...
| Autores principales: | , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2019
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6964416/ https://www.ncbi.nlm.nih.gov/pubmed/31738542 http://dx.doi.org/10.1021/acs.jctc.9b00893 |