Density Functional Theory Method for Non-Equilibrium Charge Transport Calculations: TRANSAMPA
We describe a procedure to calculate charge transport properties across a nanosystem. This scheme is based on a Green's Function formalism to treat a non-equilibrium problem, coupled to the Density Functional Theory to describe the electronic structure. As an illustration, we perform calculations fo...
Guardado en:
| Publicado en: | Brazilian Journal of Physics |
|---|---|
| Autores principales: | , , |
| Formato: | Artigo |
| Lenguaje: | Inglês |
| Publicado: |
Sociedade Brasileira de Física
2006
|
| Materias: | |
| Acceso en línea: | https://www.redalyc.org/articulo.oa?id=46413654039 |
| Etiquetas: |
Sin Etiquetas, Sea el primero en etiquetar este registro!
|