4.6 Article

Electronic structure of turbostratic graphene

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PHYSICAL REVIEW B
卷 81, 期 16, 页码 -

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AMER PHYSICAL SOC
DOI: 10.1103/PhysRevB.81.165105

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  1. Deutsche Forschungsgemeinschaft

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We explore the rotational degree of freedom between graphene layers via the simple prototype of the graphene twist bilayer, i.e., two layers rotated by some angle theta. It is shown that, due to the weak interaction between graphene layers, many features of this system can be understood by interference conditions between the quantum states of the two layers, mathematically expressed as Diophantine problems. Based on this general analysis we demonstrate that while the Dirac cones from each layer are always effectively degenerate, the Fermi velocity nu(F) of the Dirac cones decreases as theta -> 0 degrees; the form we derive for nu(F)(theta) agrees with that found via a continuum approximation in [J. M. B. Lopes dos Santos, N. M. R. Peres, and A. H. Castro Neto, Phys. Rev. Lett. 99, 256802 (2007)]. From tight-binding calculations for structures with 1.47 degrees <= theta 30 degrees we find agreement with this formula for theta greater than or similar to 5 degrees. In contrast, for theta less than or similar to 5 degrees this formula breaks down and the Dirac bands become strongly warped as the limit theta -> 0 is approached. For an ideal system of twisted layers the limit as theta -> 0 degrees is singular as for theta -> 0 the Dirac point is fourfold degenerate, while at theta = 0 one has the twofold degeneracy of the AB stacked bilayer. Interestingly, in this limit the electronic properties are in an essential way determined globally, in contrast to the nearsightedness [W. Kohn, Phys. Rev. Lett. 76, 3168 (1996)] of electronic structure generally found in condensed matter.

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