articleTop 10% cited
Special Points in the Brillouin Zone
Physical review. B, Solid state · 1973 · Vol. 8(12) · pp. 5747–5753
D. J. Chadi✉(Centre National de la Recherche Scientifique)Marvin L. Cohen(Sorbonne Université)
Abstract
We present sets of special points in the Brillouin zone from which the average over the Brillouin zone of a periodic function of wave vector (e.g., energy, charge density, dipole matrix elements, etc.) can be determined in a simple and accurate way once the values of the function at these points are specified. We discuss a method for generating the special-point sets and apply it to the case of crystals with cubic and hexagonal Bravais lattices.
Photorefractive and Nonlinear OpticsPhotonic Crystals and ApplicationsPhotonic and Optical DevicesBrillouin zoneBravais latticePhysicsDipolePoint (geometry)Simple (philosophy)Wave vectorHexagonal crystal systemMatrix (chemical analysis)Function (biology)
Citations
2,026
FWCI
8.25
field-weighted impact
References
3
Percentile
99%
vs. same field & year
Citations per year
Cited by
Special points for Brillouin-zone integrations
Physical review. B, Solid state · 1977 · 1,417 citations
Electron correlation in semiconductors and insulators: Band gaps and quasiparticle energies
Physical review. B, Condensed matter · 1986 · 3,879 citations
<i>Ab initio</i>calculation of phonon dispersions in semiconductors
Physical review. B, Condensed matter · 1991 · 1,859 citations
Spontaneous polarization and piezoelectric constants of III-V nitrides
Physical review. B, Condensed matter · 1997 · 2,999 citations
Hydrogen adsorption, absorption and diffusion on and in transition metal surfaces: A DFT study
Surface Science · 2012 · 481 citations
Linear response approach to the calculation of the effective interaction parameters in the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mi>LDA</mml:mi><mml:mo>+</mml:mo><mml:mi mathvariant="normal">U</mml:mi></mml:mrow></mml:math>method
Physical Review B · 2005 · 3,527 citations
Nonlocal pseudopotential calculations for the electronic structure of eleven diamond and zinc-blende semiconductors
Physical review. B, Solid state · 1976 · 2,000 citations
Iterative minimization techniques for<i>ab initio</i>total-energy calculations: molecular dynamics and conjugate gradients
Reviews of Modern Physics · 1992 · 9,538 citations
References
Mean-Value Point in the Brillouin Zone
Physical review. B, Solid state · 1973 · 940 citations
Related articles
Special Points in the Brillouin Zone
Physical review. B, Solid state · 1973 · 2,026 citations
Citation Network
How this paper connects to the literature. Drag to explore, click any node to open that paper.
