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Nonlocal pseudopotential calculations for the electronic structure of eleven diamond and zinc-blende semiconductors
Abstract
An empirical nonlocal pseudopotential scheme is employed to calculate the electronic structure of eleven semiconductors: Si, Ge, $\ensuremath{\alpha}\ensuremath{-}\mathrm{Sn}$, GaP, GaAs, GaSb, InP, InAs, InSb, ZnSe, and CdTe. Band structures, reflectivity spectra, electronic densities of states, and valence charge densities are presented and compared to experimental results. Improved optical gaps, optical critical-point topologies, valence-band widths, and valence charge distributions are obtained as compared to previous local pseudopotential results.
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Citations
Cited by
Semiconducting and other major properties of gallium arsenide
Blakemore, J. S. (1982) · Journal of Applied Physics · doi:10.1063/1.331665 · Cited by 2,503
Quantum confinement effects in semiconductor clusters
Rama Krishna, M. V., & Friesner, R. A. (1991) · The Journal of Chemical Physics · doi:10.1063/1.461258 · Cited by 329
Metadata
- Authors
- Chelikowsky, J. R., & Cohen, M. L.
- Venue
- Physical Review B
- Publisher
- American Physical Society (APS)
- Published
- 1976-07-15
- Volume
- 14
- Issue
- 2
- Pages
- 556-582
- ISSN
- 0556-2805 (ISSN-L)
- OpenAlex
- W1973955035
- Cited by
- 2,014
- References
- 0
- FWCI
- 26.27
- Type
- journal article
- Language
- en
- Open access
- closed
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- CoChat. (2026). Citation check: Nonlocal pseudopotential calculations for the electronic structure of eleven diamond and zinc-blende semiconductors. https://app.cochat.ai/papers/10.1103/physrevb.14.556
- The paper
- Chelikowsky, J. R., & Cohen, M. L. (1976). Nonlocal pseudopotential calculations for the electronic structure of eleven diamond and zinc-blende semiconductors. Physical Review B. https://doi.org/10.1103/physrevb.14.556
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