Carbon nanotubes band assignation, topology, Bloch states, and selection rules
- 8 January 2002
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 65 (4) , 045418
- https://doi.org/10.1103/physrevb.65.045418
Abstract
Various properties of the energy band structures (electronic, phonon, etc.), including systematic band degeneracy, sticking and extremes, following from the full line group symmetry of the single-wall carbon nanotubes are established. The complete set of quantum numbers consists of the angular and linear quasimomenta and parities with respect to the U axis and, for achiral tubes, the mirror planes. The assignation of the electronic bands is performed, and the generalized Bloch symmetry adapted eigen functions are derived. The most important physical tensors are characterized by the quantum numbers. All this enables application of the presented exhaustive selection rules. The results are discussed by some examples, e.g., allowed interband transitions, conductivity, Raman tensor, etc.Keywords
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This publication has 24 references indexed in Scilit:
- Electronic structure of polychiral carbon nanotubesPhysical Review B, 2000
- Electronic States in a Finite Carbon Nanotube: A One-Dimensional Quantum BoxPhysical Review Letters, 1999
- Symmetry and lattices of single-wall nanotubesJournal of Physics A: General Physics, 1999
- π-band contribution to the optical properties of carbon nanotubes: Effects of chiralityPhysical Review B, 1998
- Construction of tight-binding-like potentials on the basis of density-functional theory: Application to carbonPhysical Review B, 1995
- Symmetry properties of chiral carbon nanotubesPhysical Review B, 1995
- Normal vibrations and Jahn-Teller effect for polymers and quasi-one-dimensional systemsPhysical Review B, 1993
- Standard components of polar and axial vectors for quasi one-dimensional systemsPhysics Letters A, 1983
- Readily computable expressions for LCAO two-centre integrals over slater-type orbitals with arbitrarily high quantum numbersPhysica Status Solidi (b), 1979
- General expressions for reducing the Slater-Koster linear combination of atomic orbitals integrals to the two-center approximationPhysical Review B, 1979