Contribution of quantum and thermal fluctuations to the elastic moduli and dielectric constants of covalent semiconductors

Karch, K. and Dietrich, T. and Windl, W. and Pavone, P. and Mayer, A. P. and Strauch, Dieter (1996) Contribution of quantum and thermal fluctuations to the elastic moduli and dielectric constants of covalent semiconductors. PHYSICAL REVIEW B, 53 (11). pp. 7259-7266. ISSN 0163-1829

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Abstract

Using the density-functional perturbation theory, ab initio calculations have been performed for the contribution of quantum fluctuations to the bulk modulus of diamond, the dielectric constant of diamond, silicon, and germanium, and for the temperature dependence of these quantities. With these data, predictions are made for the bulk modulus and refractive index of isotopically enriched crystals. Where available, experimental data are in good agreement with our results.

Item Type: Article
Uncontrolled Keywords: LATTICE-DYNAMICS; BRILLOUIN-ZONE; SPECIAL POINTS; DIAMOND; PHONONS; SILICON; SI; COEFFICIENTS; TEMPERATURE; SOLIDS
Subjects: 500 Science > 530 Physics
Divisions: Physics > Institute of Theroretical Physics > Alumni or Retired Professors > Group Dieter Strauch
Depositing User: Dr. Gernot Deinzer
Date Deposited: 02 Nov 2023 08:53
Last Modified: 02 Nov 2023 08:53
URI: https://pred.uni-regensburg.de/id/eprint/51873

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