M. Manninen, J. Mansikka-aho, S. N. Khanna, and P. Jena, Solid State Commun. 85 , 11(1993).Manninen, M., Mansikka-Aho, J., Khanna, S. N., and Jena, P. (1993) “Band Structure of Solids Composed of Metal Clusters”, Phys. Rev. Lett . 85, 11–14....
tin/ solidsdielectric band structureWe introduce the dielectric band structure of a solid, obtained by diagonalizing its dielectric matrix, in the same way the energy band structure is defined from the Hamiltonian matrix. By means of this concept, we show how to introduce symmetry in the problem...
Introduction to the Band Structure of Solids 来自 Springer 喜欢 0 阅读量: 4 作者:A Diebold,T Hofmann 摘要: The basics of electronic band structure are reviewed in this chapter. The chapter emphasizes the tight binding model. Spin orbit interactions are also introduced in this chapter using a ...
Electronic Band Structure of Solidsphysical chemistry, reviewNo Abstract available for this article.doi:10.1038/174949a0NoneNature Publishing Group UKNature
The band structure of solids crystallizing in the rocksalt structure has been studied for arbitrary directions in reciprocal space using the parametrized tight-binding method. The results are specified in terms of a secular determinantal equation containing a minimal set of independent transfer integrals...
This handbook consists of tabulations of the Slater-Koster parameters of 53 elements in the periodic table, including metals, semiconductors, and insulators. These parameters are derived by fitting to first principles self-consistent and scalar-relativistic band structure calculations using in all cases...
We have calculated the band structure of acoustic and elastic waves propagating in two dimensional periodic fluid or solid systems respectively. In fluids, gaps are obtained easily, in contrast to the case of solids, where a large density mismatch is required. A system consisting of Au cylinders...
We conducted a large-scale density-functional theory study on the influence of the exchange-correlation functional in the calculation of electronic band gaps of solids. First, we use the large materials data set that we have recently proposed to benchmark 21 different functionals, with a particular...
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As with amorphous solids, the absence of periodic order makes it difficult to calculate the electronic structure of liquids. However, unlike the solid case, techniques for handling correlated topological disorder are standard in liquid theory. We show how recasting tight-binding models into random-mat...