arXiv subjects

D. A. Bahamon

Publications and source records attributed to D. A. Bahamon.

At least 19 recordsLinked to original sources

arXiv2026

Non-equilibrium angular momentum selectivity and filtering in chiral carbon nanotubes

Carbon nanotubes (CNTs) constitute a highly tunable platform for probing the interplay between structural chirality and quantum transport in quasi-one-dimensional systems. Here, we perform a systematic study of the non-equilibrium orbital response across a broad set of metallic and semiconducting chiral CNTs. We find that the orbital Edelstein susceptibility depends strongly on both chirality and nanotube diameter, revealing that the orbital response cannot be captured by a universal scaling law. Instead, distinct families of CNTs emerge, forming characteristic orbital-response branches uniquely determined by the chiral wrapping vector. We further investigate the role of metallic contacts on orbital-current generation and orbital selectivity. While metallic CNTs rapidly recover their intrinsic orbital response away from the contact region, semiconducting CNTs display pronounced oscillatory behavior arising from interference between transport channels carrying different angular momenta injected by wide-band metallic contacts. Finally, by incorporating angular correlations into the contact self-energy, we demonstrate that chiral CNTs can operate as efficient orbital-angular-momentum filters, selectively transmitting orbitally textured electronic states in accordance with the crystal angular momentum of the propagating bands.

cond-mat.mes-hall↗

arXiv2025

Layer-Resolved Quantum Transport in Twisted Bilayer Graphene: Counterflow and Machine Learning Predictions

The layer-resolved quantum transport response of a twisted bilayer graphene device is investigated by driving a current through the bottom layer and measuring the induced voltage in the top layer. Devices with four- and eight-layer differentiated contacts were analyzed, revealing that in a nanoribbon geometry (four contacts), a longitudinal counterflow current emerges in the top layer, while in a square-junction configuration (eight contacts), this counterflow is accompanied by a transverse, or Hall, component. These effects persist despite weak coupling to contacts, onsite disorder, lattice relaxation and variations in device size. The observed counterflow response indicates a circulating interlayer current, which generates an in-plane magnetic moment excited by the injected current. Finally, due to the intricate relationship between the electrical layer response, energy, and twist angle, a clusterized machine learning model was trained, validated, and tested to predict various conductances.

cond-mat.mes-hall↗

arXiv2025

Structural dependence of quantum transport properties on topological nodal-line semimetal bilayer borophene

This work presents the electronic and transport properties of bilayer borophene nanoribbons. In the first part, a four-orbital tight-binding model is derived by fitting the \emph{ab initio} band structure. The transport properties of armchair and zigzag bilayer borophene nanoribbons are then analyzed, both with and without periodic boundary conditions. In both scenarios, the nodal line causes conductance to increase with width and exhibit oscillations in narrow nanoribbons. Additionally, plots of current and charge density reveal that edge states have a more pronounced impact in narrower nanoribbons. Finally, uniaxial tensile strain is introduced as a tool to engineer the number of available transport channels.

cond-mat.mes-hall↗

arXiv2024

Hyperbolic phonon-plasmon polaritons in a hBN-graphene van der Waals structure

In this paper a thorough theoretical study of a new class of collective excitations, dubbed hyperbolic surface phonon plasmon polaritons, is performed. This new type of light-matter excitations are shown to have unique properties that allows to explore them both as the basis of ultra-sensitive devices to the dielectric nature of its surroundings. The system is a van der Waals heterostructure -- a layered metamaterial, composed of different 2D materials in direct contact one with another, namely graphene ribbons and hexagonal boron nitride slabs of nanometric size. In the paper we discuss the spectrum of these new class of excitations, the associated electromagnetic fields, the sensitivity to the dielectric function of its surroundings, and the absorption spectrum. All this is accomplished using an analytical model that considerably diminishes the computational burden, as well as elucidates the underling physical mechanism of the excitations supported by the device.

cond-mat.mes-hall↗

arXiv2024

Fast Fourier-Chebyshev approach to real-space simulations of the Kubo formula

The Kubo formula is a cornerstone in our understanding of near-equilibrium transport phenomena. While conceptually elegant, the application of Kubo's linear-response theory to interesting problems is hindered by the need for algorithms that are accurate and scalable to large lattice sizes beyond one spatial dimension. Here, we propose a general framework to numerically study large systems, which combines the spectral accuracy of Chebyshev expansions with the efficiency of divide-and-conquer methods. We use the hybrid algorithm to calculate the two-terminal conductance and the bulk conductivity tensor of 2D lattice models with over $10^7$ sites. By efficiently sampling the microscopic information contained in billions of Chebyshev moments, the algorithm is able to accurately resolve the linear-response properties of complex systems in the presence of quenched disorder. Our results lay the groundwork for future studies of transport phenomena in previously inaccessible regimes.

cond-mat.mes-hall↗

arXiv2023

Efficient Chebyshev polynomial approach to quantum conductance calculations: Application to twisted bilayer graphene

In recent years, Chebyshev polynomial expansions of tight-binding Green's functions have been successfully applied to the study of a wide range of spectral and transport properties of materials. However, the application of the Chebyshev approach to the study of quantum transport properties of noninteracting mesoscopic systems with leads has been hampered by the lack of a suitable Chebyshev expansion of Landaeur's formula or one of its equivalent formulations in terms of Green's functions in Keldysh's perturbation theory. Here, we tackle this issue by means of a hybrid approach that combines the efficiency of Chebyshev expansions with the convenience of complex absorbing potentials to calculate the conductance of two-terminal devices in a computationally expedient and accurate fashion. The versatility of the approach is demonstrated for mesoscopic twisted bilayer graphene (TBG) devices with up to $2.3\times10^6$ atomic sites. Our results highlight the importance of moiré effects, interlayer scattering events and twist-angle disorder in determining the conductance curves in devices with a small twist angle near the TBG magic angle $θ_m \approx 1.1^\circ$.

cond-mat.mes-hall↗

arXiv2022

A critical analysis on the sensitivity enhancement of surface plasmon resonance sensors with graphene

The use of graphene in surface plasmon resonance sensors, covering a metallic (plasmonic) film, has a number of demonstrated advantages, such protecting the film against corrosion/oxidation and facilitating the introduction of functional groups for selective sensing. Recently, a number of works have claimed that few-layer graphene can also increase the sensitivity of the sensor. However, graphene was treated as an isotropic thin film, with an out-of-plane refractive index that is identical to the in-plane index. Here, we critically examine the role of single and few layers of graphene in the sensitivity enhancement of surface plasmon resonance sensors. Graphene is introduced over the metallic film via three different descriptions: as an atomic-thick two-dimensional sheet, as a thin effective isotropic material (same conductivity in the three coordinate directions), and as an non-isotropic layer (different conductivity in the perpendicular direction to the two-dimensional plane). We find that only the isotropic layer model, which is known to be incorrect for the optically modelling of graphene, provides sizeable sensitivity increases, while the other, more accurate, models lead to negligible contribution to the sensitivity.

cond-mat.mes-hall↗

arXiv2022

Relaxing graphene plasmon excitation constraints through the use of an epsilon-near-zero substrate

Graphene plasmons have attracted significant attention due to their tunability, potentially long propagation lengths and ultracompact wavelengths. However, the latter characteristic imposes challenges to light-plasmon coupling in practical applications, generally requiring sophisticated coupling setups, extremely high doping levels and/or graphene nanostructuting close to the resolution limit of current lithography techniques. Here, we propose and theoretically demonstrate a method for alleviating such a technological strain through the use of a practical substrate whose low and negative dielectric function naturally enlarges the graphene polariton wavelength to more manageable levels. We consider silicon carbide (SiC), as it exhibits a dielectric function whose real part is between -1 and 0, while its imaginary part remains lower than 0.05, in the 951 to 970 cm$^{-1}$ mid-infrared spectral range. Our calculations show hybridization with the substrate's phonon polariton, resulting in a polariton wavelenth that is an order of magnitude longer than obtained with a silicon dioxide substrate, while the propagation length increases by the same amount.

physics.optics↗

arXiv2020

Emergent magnetic texture in driven twisted bilayer graphene

The transport properties of a twisted bilayer graphene barrier are investigated for various twist angles. Remarkably, for small twist angles around the magic angle $θ_m \sim 1.05^{\circ}$, the local currents around the AA-stacked regions are strongly enhanced compared to the injected electron rate. Furthermore, the total and counterflow (magnetic) current patterns show high correlations in these regions, given rise to well-defined magnetic moments that form a magnetic Moiré superlattice. The orientation and magnitude of these magnetic moments changes as function of the gate voltage and possible implications for emergent spin-liquid behaviour are discussed.

cond-mat.mes-hall↗

arXiv2019

Valley notch filter in a graphene strain superlattice: Green's function and machine learning approach

The valley transport properties of a superlattice of out-of-plane Gaussians deformations are calculated using a Green's function and a Machine Learning approach. Our results show that periodicity significantly improves the valley filter capabilities of a single Gaussian deformation, these manifest themselves in the conductance as a sequence by valley filter plateaus. We establish that the physical effect behind the observed valley notch filter is the coupling between counter-propagating transverse modes; the complex relationship between the design parameters of the superlattice and the valley filter effect make difficult to estimate in advance the valley filter potentialities of a given superlattice. With this in mind, we show that a Deep Neural Network can be trained to predict valley polarization with a precision similar to the Green's function but with much less computational effort.

cond-mat.mes-hall↗

arXiv2017

Quantized transport, strain-induced perfectly conducting modes and valley filtering on shape-optimized graphene Corbino devices

The extreme mechanical resilience of graphene and the peculiar coupling it hosts between lattice and electronic degrees of freedom have spawned a strong impetus towards strain-engineered graphene where, on the one hand, strain augments the richness of its phenomenology and makes possible new concepts for electronic devices and, on the other hand, new and extreme physics might take place. Here, we demonstrate that the shape of substrates supporting graphene sheets can be optimized for approachable experiments where strain-induced pseudomagnetic fields (PMF) can be tailored by pressure for directionally selective electronic transmission and pinching-off of current flow down to the quantum channel limit. The Corbino-type layout explored here furthermore allows filtering of charge carriers according to valley and current direction, which can be used to inject or collect valley-polarized currents, thus realizing one of the basic elements required for valleytronics. Our results are based on a framework developed to realistically determine the combination of strain, external parameters, and geometry optimally compatible with the target spatial profile of a desired physical property --- the PMF in this case. Characteristic conductance profiles are analyzed through quantum transport calculations on large graphene devices having the optimal shape.

cond-mat.mes-hall↗

arXiv2016

Resonant tunneling through protected quantum dots at phosphorene edges

We theoretically investigate phosphorene zigzag nanorribons as a platform for constriction engineering. In the presence of a constriction at the upper edge, quantum confinement of edge protected states reveals resonant tunnelling Breit-Wigner transmission peaks, if the upper edge is uncoupled to the lower edge. Coupling between edges in thin constrictions gives rise to Fano-like and anti-resonances in the transmission spectrum of the system.

cond-mat.mes-hall↗

arXiv2016

Graphene kirigami as a platform for stretchable and tunable quantum dot arrays

The quantum transport properties of a graphene kirigami similar to those studied in recent experiments are calculated in the regime of elastic, reversible deformations. Our results show that, at low electronic densities, the conductance profile of such structures replicates that of a system of coupled quantum dots, characterized by a sequence of minibands and stop-gaps. The conductance and I-V curves have different characteristics in the distinct stages of elastic deformation that characterize the elongation of these structures. Notably, the effective coupling between localized states is strongly reduced in the small elongation stage, whereas in the large elongation regime the development of strong, localized pseudomagnetic field barriers can reinforce the coupling and reestablish resonant tunneling across the kirigami. This provides an interesting example of interplay between geometry and pseudomagnetic field-induced confinement. The alternating miniband and stop-gaps in the transmission lead to I-V characteristics with negative differential conductance in well defined energy/doping ranges. These effects should be stable in a realistic scenario that includes edge roughness and Coulomb interactions, as these are expected to further promote localization of states at low energies in narrow segments of graphene nanostructures.

cond-mat.mes-hall↗

arXiv2016

Edge phonons in black phosphorus

Exfoliated black phosphorus has recently emerged as a new two-dimensional crystal that, due to its peculiar and anisotropic crystalline and electronic band structures, may have potentially important applications in electronics, optoelectronics and photonics. Despite the fact that the edges of layered crystals host a range of singular properties whose characterization and exploitation are of utmost importance for device development, the edges of black phosphorus remain poorly characterized. In this work, the atomic structure and the behavior of phonons near different black phosphorus edges are experimentally and theoretically studied using Raman spectroscopy and density functional theory calculations. Polarized Raman results show the appearance of new modes at the edges of the sample, and their spectra depend on the atomic structure of the edges (zigzag or armchair). Theoretical simulations confirm that the new modes are due to edge phonon states that are forbidden in the bulk, and originated from the lattice termination rearrangements.

cond-mat.mtrl-sci↗

arXiv2015

Conductance signatures of electron confinement induced by strained nanobubbles in graphene

We investigate the impact of strained nanobubbles on the conductance characteristics of graphene nanoribbons using a combined molecular dynamics - tight-binding simulation scheme. We describe in detail how the conductance, density of states, and current density of zigzag or armchair graphene nanoribbons are modified by the presence of a nanobubble. In particular, we establish that low-energy electrons can be confined in the vicinity or within the nanobubbles by the delicate interplay between the pseudomagnetic field pattern created by the shape of the bubble, mode mixing, and substrate interaction. The coupling between confined evanescent states and propagating modes can be enhanced under different clamping conditions, which translates into Fano resonances in the conductance traces.

cond-mat.mes-hall↗

arXiv2014

Current flow in biased bilayer graphene: the role of sublattices

We investigate here how the current flows over a bilayer graphene in the presence of an external electric field perpendicularly applied (biased bilayer). Charge density polarization between layers in these systems is known to create a layer pseudospin, which can be manipulated by the electric field. Our results show that current does not necessarily flow over regions of the system with higher charge density. Charge can be predominantly concentrated over one layer, while current flows over the other layer. We find that this phenomenon occurs when the charge density becomes highly concentrated over only one of the sublattices, as the electric field breaks layer and sublattice symmetries for a Bernal-stacked bilayer. For bilayer nanoribbons, the situation is even more complex, with a competition between edge and bulk effects for the definition of the current flow. We show that, in spite of not flowing trough the layer where charge is polarized to, the current in these systems also defines a controllable layer pseudospin.

cond-mat.mes-hall↗

arXiv2013

Conductance across strain junctions in graphene nanoribbons

To address the robustness of the transport gap induced by locally strained regions in graphene nanostructures, the effect of disorder and smoothness of the interface region is investigated within the Landauer-Büttiker formalism. The electronic conductance across strained junctions and barriers in graphene nanoribbons is calculated numerically, with and without various types of disorder, and comparing smooth and sharp strain junctions. A smooth strain barrier in graphene is seen to be generically as efficient in suppressing transport at low densities as a sharp one, and the critical density (or energy) for the onset of transmission depends on the strain orientation with respect to the ribbon. In addition, hopping (or strain) inhomogeneity and work function mismatch at the interface region do not visibly degrade the transport gap. These results show that the strain-induced transport gap at a strain junction is robust to more realistic strain conditions.

cond-mat.mes-hall↗

arXiv2013

Effective contact model for geometry-independent conductance calculations in graphene

A geometry-independent effective model for the contact self-energies is proposed to calculate the quantum conductance of patterned graphene devices using Green's functions. A Corbino disk, being the simplest device where the contacts can not be modeled as semi-infinite ribbons, is chosen to illustrate this approach. This system's symmetry allows an analytical solution against which numerical calculations on the lattice can be benchmarked. The effective model perfectly describes the conductance of Corbino disks at low-to-moderate energies, and is robust against the size of the annular device region, the number of atoms on the edge, external magnetic fields, or electronic disorder. The contact model considered here affords an expedite, flexible, and geometry-agnostic approach easily allows the consideration of device dimensions encompassing several million atoms, and realistic radial dimensions of a few hundreds of nanometers.

cond-mat.mes-hall↗