Impurities in a biased graphene bilayer

We study the problem of impurities and midgap states in a biased graphene bilayer. We show that the properties of the bound states, such as localization lengths and binding energies, can be controlled externally by an electric field effect. Moreover, the band gap is renormalized and impurity bands are created at finite impurity concentrations. Using the coherent potential approximation, we calculate the electronic density of states and its dependence on the applied bias voltage.     

Electronic heat capacity and conductivity of gapped graphene

It investigated the effects of orderly substituted atoms on density of states, electronic heat capacity and electrical conductivity of graphene plane within tight-binding Hamiltonian model and Green's function method. The results reveal a band gap in the density of states, leading to an acceptor or donor semiconductor. In the presence of foreign atoms, the heat capacity decreases (increases) before (after) the Schottky anomaly. Moreover, the electrical conductivity of the gapped graphene reduces on all ranges of temperature compared to the pristine case. Deductively, all changes in the electronic properties depend on the difference between the on-site energies of the carbon and replaced atoms.     

Edge physics of graphene in the quantum Hall regime

We study the electronic edge states of graphene in the quantum Hall regime. For non-interacting electrons, graphene supports both electron-like and hole-like edge states. We find there are half as many edge states of each type in the lowest Landau level compared to higher Landau levels, leading to a quantization of the Hall conductance that is shifted relative to standard two dimensional electron gases. We also consider the effect of quantum Hall ferromagnetism on this edge structure, and find an unusual Luttinger liquid at the edge in undoped graphene. This arises due to a domain wall that forms near the edge between partially spin-polarized and valley-polarized regions. The domain wall has a U(1) degree of freedom which generates both collective and charged gapless excitations, whose consequences for tunneling experiments are discussed.     

Lorentz Violation and Topologically Trapped Fermions in 2+1 Dimensions

The full spectrum of two‐dimensional fermion states in a scalar soliton trap with a Lorentz breaking background is investigated in the context of graphene, where the Lorentz symmetry should not be strictly valid. The field theoretical model with Lorentz breaking terms represents Dirac electrons in one valley and in a scalar field background. The Lorentz violation comes from the difference between the Dirac electron and scalar mode velocities, which should be expected when modelling the electronic and lattice excitations in graphene. Here, only one Lorentz‐violating parameter is considered, belonging to the scalar sector. The analytical methods developed in the context of 1+1 field theories are extended to explore the effect of the Lorentz symmetry breaking in the charge carrier density of two‐dimensional materials in the presence of a domain wall with a kink profile. The width and the depth of the trapping potential from the kink is controlled by the Lorentz violating term, which is reflected analytically in the band structure and properties of the trapped states. These findings enlarge previous studies of the edge states obtained with domain wall and in strained graphene nanoribbon in a chiral gauge theory.     

Engineering the electronic structure of graphene superlattices via Fermi velocity modulation

Graphene superlattices have attracted much research interest in the last years, since it is possible to manipulate the electronic properties of graphene in these structures. It has been verified that extra Dirac points appear in the electronic structure of the system. The electronic structure in the vicinity of these points has been studied for a gapless and gapped graphene superlattice and for a graphene superlattice with a spatially modulated energy gap. In each case a different behavior was obtained. In this work we show that via Fermi velocity engineering it is possible to tune the electronic properties of a graphene superlattice to match all the previous cases studied. We also obtained new features of the system never observed before, reveling that the electronic structure of graphene is very sensitive to the modulation of the Fermi velocity. The results obtained here are relevant for the development of novel graphene-based electronic devices.     

Quantum spin Hall effect in graphene

We study the effects of spin orbit interactions on the low energy electronic structure of a single plane of graphene. We find that in an experimentally accessible low temperature regime the symmetry allowed spin orbit potential converts graphene from an ideal two-dimensional semimetallic state to a quantum spin Hall insulator. This novel electronic state of matter is gapped in the bulk and supports the transport of spin and charge in gapless edge states that propagate at the sample boundaries. The edge states are nonchiral, but they are insensitive to disorder because their directionality is correlated with spin. The spin and charge conductances in these edge states are calculated and the effects of temperature, chemical potential, Rashba coupling, disorder, and symmetry breaking fields are discussed.     

Effect of a gap opening on the conductance of graphene superlattices

The electronic transmission and conductance of a gapped graphene superlattice were calculated by means of the transfer-matrix method. The system that we study consists of a sequence of electron-doped graphene as wells and hole-doped graphene as barriers. We show that the transmission probability approaches unity at some critical value of the gap. We also find that there is a domain around the critical gap value for which the conductance of the system attains its maximum value.     

Topological confinement in bilayer graphene

We study a new type of one-dimensional chiral states that can be created in bilayer graphene (BLG) by electrostatic lateral confinement. These states appear on the domain walls separating insulating regions experiencing the opposite gating polarity. While the states are similar to conventional solitonic zero modes, their properties are defined by the unusual chiral BLG quasiparticles, from which they derive. The number of zero mode branches is fixed by the topological vacuum charge of the insulating BLG state. We discuss how these chiral states can manifest experimentally and emphasize their relevance for valleytronics.     

Origin of anomalous electronic structures of epitaxial graphene on silicon carbide

On the basis of first-principles calculations, we report that a novel interfacial atomic structure occurs between graphene and the surface of silicon carbide, destroying the Dirac point of graphene and opening a substantial energy gap there. In the calculated atomic structures, a quasiperiodic 6x6 domain pattern emerges out of a larger commensurate 6 sqrt [3] x 6 sqrt [3]R30 degrees periodic interfacial reconstruction, resolving a long standing experimental controversy on the periodicity of the interfacial superstructures. Our theoretical energy spectrum shows a gap and midgap states at the Dirac point of graphene, which are in excellent agreement with the recently observed anomalous angle-resolved photoemission spectra. Beyond solving unexplained issues in epitaxial graphene, our atomistic study may provide a way to engineer the energy gaps of graphene on substrates.     

Domain wall conductivity in La-doped BiFeO3

The transport physics of domain wall conductivity in La-doped bismuth ferrite (BiFeO3) has been probed using variable temperature conducting atomic force microscopy and piezoresponse force microscopy in samples with arrays of domain walls in the as-grown state. Nanoscale current measurements are investigated as a function of bias and temperature and are shown to be consistent with distinct electronic properties at the domain walls leading to changes in the observed local conductivity. Our observation is well described within a band picture of the observed electronic conduction. Finally, we demonstrate an additional degree of control of the wall conductivity through chemical doping with oxygen vacancies, thus influencing the local conductive state.     

Magnetic moment softening and domain wall resistance in Ni nanowires

We perform ab initio calculations of the electronic structure and conductance of atomic-size Ni nanowires with domain walls only a few atomic lattice constants wide. We show that the hybridization between noncollinear spin states leads to a reduction of the magnetic moments in the domain wall resulting in the enhancement of the domain wall resistance. Experimental studies of the magnetic moment softening may be feasible with modern techniques such as scanning tunneling spectroscopy.     

Photo-Induced Metastable Effects in Hydrogenated Amorphous Silicon (a-Si:H)

Light induced changes of electronic properties are studied in glow discharge deposited a-Si: H-films by ESR, field effect, DLTS and electronic transport. These effects are caused by silicon dangling bonds generated by recombination processes, which raise the density of states near midgap. The concomitant increase of potential fluctuations indicates that these defects are inhomogeneously distributed.     

Size quantization in planar graphene-based heterostructures: Pseudospin splitting,interface states,and excitons

A planar quantum-well device made of a gapless graphene nanoribbon with edges in contact with gapped graphene sheets is examined. The size-quantization spectrum of charge carriers in an asymmetric quantum well is shown to exhibit a pseudospin splitting. Interface states of a new type arise from the crossing of dispersion curves of gapless and gapped graphene materials. The exciton spectrum is calculated for a planar graphene quantum well. The effect of an external electric field on the exciton spectrum is analyzed.     

Breather states in magnetic domain wall racetrack memory samples

Magnetic domain wall racetrack memory samples allow for the controlled motion of isolated magnetic domain walls in a quasi one-dimensional geometry. Here we consider the possibility of the dynamical formation of bound states of domain walls that can be prepared via a suitably chosen external field. Upon switching off the external field, these domain walls oscillate around their common center of mass, with a frequency depending on the relative initial handedness of the domain wall. Such breather states may be observed by detecting the resulting magnetization oscillations.     

Helical states around a mass-inverted quantum dot in graphene

Topologically protected helical states at a mass-inverted quantum dot in graphene are studied by analyzing both tight-binding and kernel polynomial method calculations. The mass-inverted quantum dot is introduced by considering a heterojunction between two different mass domains, which is similar to the domain wall in bilayer graphene. The numerical results show emergent metallic channels across the mass gap when the signs of the mass terms are opposite. The eigenstates of the metallic channels are revealed to be doubly degenerate—each state propagates along opposite directions, maintaining the time-reversal symmetry of graphene. The robustness of the metallic channels is further examined, concluding with the fact that helical states are secured unless atomic vacancies form near the domain wall. Such helical states circulating along the topological defects may pave a novel route to engineering topological states based on graphene.     

Electronic and magnetic properties of silicon adsorption on graphene

Graphene has proved to be extremely sensitive to its surrounding environment, such as the supporting substrate and guest adatoms. In this work, the structural stabilities, and electronic and magnetic properties of graphene with low-coverage adsorption of Si atoms and dimers are studied using a first-principles method. Our results show that graphene with Si adatoms is metallic and magnetic with a tiny structural change in the graphene, while graphene with Si addimers is semi-metallic and nonmagnetic with a visible deformation of the graphene. The spin-polarized density of states is calculated in order to identify the electronic origin of the magnetic and nonmagnetic states. The present results suggest that the electronic and magnetic behaviors of graphene can be tuned simply via Si adsorptions.     

NMR parameters in gapped graphene systems

We calculate the nuclear spin-lattice relaxation time and the Knight shift for the case of gapped graphene systems. Our calculations consider both the massive and massless gap scenarios. Both the spin-lattice relaxation time and the Knight shift depend on temperature, chemical potential, and the value of the electronic energy gap. In particular, at the Dirac point, the electronic energy gap has stronger effects on the system nuclear magnetic resonance parameters in the case of the massless gap scenario. Differently, at large values of the chemical potential, both gap scenarios behave in a similar way and the gapped graphene system approaches a Fermi gas from the nuclear magnetic resonance parameters point of view. Our results are important for nuclear magnetic resonance measurements that target the ¹³C active nuclei in graphene samples.     

Concentration-dependent electronic structure and optical absorption properties of B-doped anatase TiO2

The concentration-dependent electronic structures and optical properties of B-doped anatase TiO₂ have been calculated using the density functional theory. The calculated results indicate that the electronic structures of B-doped TiO₂ have changed compared with those of pure TiO₂, which is mainly due to the new midgap states induced by B doping. As to the optical properties, we calculate the imaginary part of dielectric function ε₂(ω) and optical absorption spectra of pure and B-doped TiO₂. Two transitions E₁ and E₂ emerged after B doping. The intensity of absorption is enhanced by B doping both in the UV and visible regions. According to the results of imaginary part of dielectric function ε₂(ω) and DOS, it can be concluded that the two optical transitions correspond to the transitions from the O 2p states in the top of valence band to the midgap states and from the midgap states to the Ti 3d states in the bottom of conduction band, respectively. These results have important implications for the further development of photocatalytic materials.     

类石墨烯复杂晶胞光子晶体中的确定性界面态

拓扑绝缘体是当前凝聚态物理领域研究的热点问题.利用石墨烯材料的特殊能带特性来实现拓扑输运特性在设计下一代电子和能谷电子器件方面具有较广泛的应用前景.基于光子与电子的类比,利用光子拓扑材料实现了确定性界面态;构建了具有C_(6v)。对称性的类似石墨烯结构的的光子晶体复杂晶格;通过多种方式降低晶格对称性来获得具有C_(3v),C_3,C_(2v)和C_2对称的晶体,从而打破能谷简并实现全光子带隙结构;将体拓扑性质不同的两种光子晶体摆放在一起,在此具有反转体能带性质的界面上,实现了具有单向传输特性的拓扑确定性界面态的传输.利用光子晶体结构的容易加工性,可以简便地调控拓扑界面态控制光的传播,可为未来光拓扑绝缘体的研究提供良好的平台.     

Enlargement of omnidirectional electronic gap in the graphene superlattice heterostructures with Gaussian profile potential voltages

A valid method is used to extend the omnidirectional electronic gap (OEG) of Gaussian gapped graphene superlattices (GSLs) heterostructure. The heterostructure consists of two superlattices with different width ratios of potentials. Each superlattice comprises a periodic repetition of a unit cell consisting of 21 layers with the potential voltages varying according to a Gaussian function and another layer with a fixed potential voltage. The potential width ratios of constituent Gaussian gapped GSL are established utilizing the lower and upper energy edges of omnidirectional electronic gap depending on the width ratio of potentials. Moreover, it is shown that the width of OEG of the heterostructure is sensitive to lattice constant, which can be applicable to the development of graphene-based electronics.