Accurate and transferable extended Huckel-type tight-binding parameters

By J. Cerdá, F. Soria. 2000

167 citations recorded by the source corpus.

Subfields: Atomic and Molecular Physics, and Optics, Electronic, Optical and Magnetic Materials, Inorganic Chemistry

View Paper: https://www.semanticscholar.org/paper/b6c312235ff4c4d01864874976709616d745b792

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

In Atomic and Molecular Physics, and Optics

1. Alexander L. Shluger
2. Werner A. Hofer
3. Adam S. Foster
4. F. Rosei

In Electronic, Optical and Magnetic Materials

1. Alexander L. Shluger
2. Werner A. Hofer
3. Adam S. Foster

In Inorganic Chemistry

1. Alexander L. Shluger
2. Werner A. Hofer
3. Adam S. Foster

Citations in the corpus

• Theories of scanning probe microscopes at the atomic scale (2003, methodology): “…and existing codes more and more rely on firstprinciples density-functional theory (Wimmer et al., 1985; Kresse and Hafner, 1993; Kresse and Furthmüller, 1996), or, in case of tight-binding models (Turchi et al., 1998), they obtain their parameters from a fit to DFT data (Cerda and Soria, 2000).”