arXiv subjects

Reza Asgari

Publications and source records attributed to Reza Asgari.

At least 55 records · Page 3Linked to original sources

arXiv2022

Unidirectional valley-contrasting photo-current in strained transition metal dichalcogenide monolayers

We examine the full static non-linear optical response of uniaxially strained transition metal dichalcogenide monolayers doped with a finite carrier density in the conduction band, in the presence of disorder. We find that the customary shift current is suppressed, yet we identify a strong, valley-dependent non-reciprocal response, which we term a \textit{unidirectional valley-contrasting photo-current} (UVCP). This DC current originates from the combined effect of strain and Kramers symmetry breaking by trigonal warping, while the contributions due to individual valleys can be separated by introducing an energy offset between them by means of a magnetization. This latter fact enables one to monitor inter-valley transitions. The UVCP is proportional to the mobility and is enhanced by the excitonic Coulomb interaction and inter-valley scattering, as well as by a top gate bias. We discuss detection strategies in state-of-the-art experiments.

cond-mat.mes-hall↗

arXiv2022

Quadrupolar photovoltaic effect in the terahertz range in a two-dimensional spin-3/2 hole system

We identify a strong photovoltaic response due to the non-linear optical transition between heavy and light hole sub-bands enabled by T_d-symmetry in a quantum well, which we term the quadrupolar photovoltaic effect (QPE). The photovoltaic current exhibits a strong resonance in the vicinity of the heavy hole-light hole splitting, with a magnitude governed by the momentum relaxation time, which can reach nanoseconds in GaAs holes. Since the heavy hole-light hole splitting can be tuned from a few meV to nearly 100 meV the QPE could serve as the basis for a terahertz photo-detector. We discuss strategies for experimental observation and device applications.

cond-mat.mes-hall↗

arXiv2021

Quasiparticle band-gap renormalization in doped monolayer MoS$_2$

The quasiparticle band-gap renormalization induced by the doped carriers is an important and well-known feature in two-dimensional semiconductors, including transition-metal dichalcogenides (TMDs), and it is of both theoretical and practical interest. To get a quantitative understanding of this effect, here we calculate the quasiparticle band-gap renormalization of the electron-doped monolayer MoS$_2$, a prototypical member of TMDs. The many-body electron-electron interaction induced renormalization of the self-energy is found within the random phase approximation and to account for the quasi-2D character of the Coulomb interaction in this system a Keldysh-type interaction with a nonlocal dielectric constant is used. Considering the renormalization of both the valence and the conduction bands, our calculations reveal a large and nonlinear band-gap renormalization upon adding free carriers to the conduction band. We find a 410 meV reduction of the band gap for the monolayer MoS$_2$ on SiO$_2$ substrate at the free carrier density $n=4.9\times 10^{12} \rm{cm^{-2}}$ which is in excellent agreement with available experimental results. We also discuss the role of exchange and correlation parts of the self-energy on the overall band-gap renormalization of the system. The strong dependence of the band-gap renormalization on the surrounding dielectric environment is also demonstrated in this work, and a much larger shrinkage of the band gap is predicted for the freestanding monolayer MoS$_2$.

cond-mat.mes-hall↗

arXiv2021

Hyperbolic plasmon modes in tilted Dirac cone phases of borophene

Hyperbolic materials are receiving significant attention due to their ability to support electromagnetic fields with arbitrarily high momenta and, hence, to achieve very strong light confinement. Here, based on first-principles calculations and many-body perturbation theory, we explore the characteristic of two-dimensional plasmon modes and its hyperbolic properties for two phases of single layer boron hosting tilted Dirac cone, namely, the $hr$-$sB$ and $8Pmmn$ borophene. In-plane anisotropy in borophene is manifested in the structural, electronic, vibrational and optical properties. We find two hyperbolic regimes for both phases of borophene, where the high-energy one is located in the visible range. The $hr$-$sB$ borophene is characterised with an intrinsic high carrier density and it supports strong hyperbolic plasmon modes in the visible part of the spectrum. The $8Pmmn$ borophene, on the other hand, resembles the prototypical Dirac material graphene, and upon carrier doping acquires anisotropic Dirac plasmons in the mid-infrared. We have also investigated the impact of the electron-phonon coupling and Landau damping on these hyperbolic plasmon modes. Our results show that borophene, having high anisotropy, intrinsic high carrier concentration, low-loss hyperbolic Dirac plasmon modes, and high confinement can represent a promising candidate for low-loss broad band surface plasmon polariton devices.

cond-mat.mtrl-sci↗

arXiv2021

Natural hyperbolicity in the layered hexagonal crystal structure

Discovering the physical requirements for meeting the indefinite permittivity in natural material as well as proposing a new natural hyperbolic media offer a possible route to significantly improve our knowledge and ability to confine and controlling light in optoelectronic devices. We demonstrate the hyperbolicity in a class of materials with hexagonal P6/mmm and P6$_{3}$/mmc layered crystal structures and its physical origin is thoroughly investigated. By utilizing density functional theory and solving the Bethe-Salpeter equation (BSE), we find that the layered crystal structure and symmetry imposed constraints in Li$_{3}$N gives rise to an exceedingly strong anisotropy in optical responses along in- and out-of-plane directions of the crystals making it a natural hyperbolic in a broad spectral range from the visible spectrum to the ultraviolet. More excitingly, the hyperbolicity relation to anisotropic interband absorption in addition to the impressive dependency of the conduction band to the lattice constant along the out-of-plane direction provide the hyperbolicity tunability in these hexagonal structures under strain, doping, and alloying. Our findings not only suggest a large family of real hexagonal compounds as a unique class of materials for realization of the highly tunable broad band hyperbolicity but also offers an approach to search for new hyperbolic

cond-mat.mtrl-sci↗

arXiv2021

Anomalous plasmon mode in strained Weyl semimetals

An exotic anomalous plasmon mode is found in strained Weyl semimetals utilizing the topological Landau Fermi liquid and chiral kinetic theories, in which quasiparticle interactions are modeled by long-range Coulomb and residual short-range interactions. The gapped collective mode is derived from the dynamical charge pumping between the bulk and the surface and behaves like $k_{\rm F}^{-1}$. The charge oscillations are accurately determined by the coupling between the induced electric field and the background pseudofields. This novel mode unidirectionally disperses along the pseudomagnetic field and manifests itself in an unusual thermal conductivity in apparent violation of the Wiedemann-Franz law. The excitation can be achieved experimentally by mechanical vibrations of the crystal lattice in the THz regime.

cond-mat.mes-hall↗

arXiv2021

Charge density wave and superconducting phase in monolayer InSe

In this paper, the completed investigation of a possible superconducting phase in monolayer indium selenide is determined using first-principles calculations for both the hole and electron doping systems. The hole-doped dependence of the Fermi surface is exclusively fundamental for monolayer InSe. It leads to the extensive modification of the Fermi surface from six separated pockets to two pockets by increasing the hole densities. For low hole doping levels of the system, below the Lifshitz transition point, superconductive critical temperatures $T_c \sim 55-75$ K are obtained within anisotropic Eliashberg theory depending on varying amounts of the Coulomb potential from 0.2 to 0.1. However, for some hole doping above the Lifshitz transition point, the combination of the temperature dependence of the bare susceptibility and the strong electron-phonon interaction gives rise to a charge density wave that emerged at a temperature far above the corresponding $T_c$. Having included non-adiabatic effects, we could carefully analyze conditions for which either a superconductive or charge density wave phase occurs in the system. In addition, monolayer InSe becomes dynamically stable by including non-adiabatic effects for different carrier concentrations at room temperature.

cond-mat.mtrl-sci↗

arXiv2020

New supercurrent pattern in quantum point contact with strained graphene nanoribbon

We theoretically reveal the unusual features of the Josephson effect in a strained zigzag graphene nanoribbon with a small length relative to the superconducting coherence length and an arbitrary width. We find a step-wise variation of the critical supercurrent with the width of the nanoribbon, showing additional small width plateaus placed between the broad steps of a unstrained structure. We further demonstrate the peculiar quantization of the critical supercurrent in terms of the strain, resulted from the coupling of the pseudospin of Dirac fermions with the strain-induced gauge potential, where the height of the steps decreases with growing the strength of the fictitious gauge potential. Moreover, our results determine the potential of the proposed superconducting quantum point contact for the realization of the supercurrent switch under an applied strain. Besides, we find the local density of states of the strained zigzag nanoribbon displays a crossover between the decaying and oscillating behavior with the distance from the edges, by tuning the width and Fermi wavelength of the nanoribbon.

cond-mat.mes-hall↗

arXiv2020

Rydberg-dressed Fermi liquid: correlations and signatures of droplet crystallization

We investigate the effects of many-body correlations on the ground-state properties of a single component ultra-cold Rydberg-dressed Fermi liquid with purely repulsive inter-particle interactions, in both three and two spatial dimensions. We have employed the Fermi-hypernetted-chain Euler-Lagrange approximation and observed that the contribution of the correlation energy on the ground-state energy becomes significant at intermediate values of the soft-core radius and large coupling strengths. For small and large soft-core radii, the correlation energy is negligible and the ground-state energy approaches the Hartree-Fock value. The positions of the main peaks in static structure factor and pair distribution function in the homogeneous fluid phase signal the formation of quantum droplet crystals with several particles confined inside each droplet.

cond-mat.quant-gas↗

arXiv2020

Tunable Low-Loss Hyperbolic Plasmon Polaritons in a T$_{d}\,$-WTe$_2$ Single Layer

Natural hyperbolic two-dimensional systems are a fascinating class of materials that could open alternative pathways to the manipulation of plasmon propagation and light-matter interactions. Here, we present a comprehensive study of the optical response in T$_d\,$-WTe$_2$ by means of density-functional and many-body perturbation theories. We show how monolayer WTe$_2$ with in-plane anisotropy sustains hyperbolic plasmon polaritons, which can be tuned via chemical doping and strain. The latter is able to extend the hyperbolic regime toward the near infrared with low losses. Moreover, with a moderate strain, WTe$_2$ can even be switched between elliptic and hyperbolic regimes. In addition, plasmons in WTe$_2$ are characterized by low losses owing to electron-phonon scattering, which is responsible for the temperature dependence of the plasmon line width. Interestingly, the temperature can also be utilized to tune the in-plane anisotropy of the WTe$_2$ optical response.

cond-mat.mtrl-sci↗

arXiv2020

Topological phases in $α$-Li$_{\rm 3}$N-type crystal structure of light-element compounds

Materials with tunable topological features, simple crystal structure and flexible synthesis, are in extraordinary demand towards technological exploitation of unique properties of topological nodal points. The controlled design of the lattice geometry of light elements is determined by utilizing density functional theory and the effective Hamiltonian model together with the symmetry analysis. This provides an intriguing venue for reasonably achieving various distinct types of novel fermions. We, therefore, show that a nodal line (type-I and II), Dirac fermion, and triple point (TP) fermionic excitation can potentially appear as a direct result of a band inversion in group-I nitrides with $α$-Li$_{\rm 3}$N-type crystal structure. The imposed strain is exclusively significant for these compounds, and it invariably leads to the considerable modification of the nodal line type. Most importantly, a type-II nodal loop can be realized in the system under strain. These unique characteristics make $α$-Li$_{\rm 3} $N-type crystal structure an ideal playground to achieve various types of novel fermions well-suited for technological applications.

cond-mat.mtrl-sci↗

arXiv2020

Many-body exchange-correlation effects in MoS$_2$ monolayer: The key role of nonlocal dielectric screening

We calculate the quasiparticle properties of $\rm{MoS_2}$ monolayer at $T=0$ considering the dynamical electron-electron interaction effect within random-phase-approximation (RPA). The calculations are carried out for an electron-doped slab of $\rm{MoS_2}$ monolayer using a minimal massive Dirac Hamiltonian and the quasi-two-dimensional nature of the Coulomb interaction in this system is taken into account considering a modified interaction of Keldysh type. Having calculated the real and imaginary parts of the retarded self-energy, we find the spectral function and discuss the impact of extrinsic variables such as the dielectric medium and the charge carrier density on the appearance and position of the quasiparticle peaks. We also report the results of the renormalization constant and the effective Fermi velocity calculations in a broad range of the coupling constant and carrier density. We show that the effective Fermi velocity obtained solving the self-consistent Dyson equation has an absolutely different behavior from the one found from the on-shell approximation. Our results show that the nonlocal dielectric screening of the monolayer tends to stabilize the Fermi liquid picture in $\rm{MoS_2}$ monolayer and that the interaction strength parameter of this system is a multivariable function of the coupling constant, carrier density, and also the screening length.

cond-mat.mes-hall↗

arXiv2020

Probing divacancy defects in a zigzag graphene nanoribbon through RKKY exchange interaction

We investigate the effect of vacancy defects on the electronic and magnetic properties of zigzag graphene nanoribbons (zGNRs) by making use of the Green's function formalism in combination with the tight-binding Hamiltonian. The evolution of the indirect exchange coupling, known as Ruderman-Kittel-Kasuya-Yosida (RKKY) interaction, including single, double, and multiple 5-8-5 divacancy defects is explained. Our numerical calculations show that the changes in the electronic structure and the exchange coupling of zGNRs depend significantly on the location of the divacancy defects with respect to the ribbon edges and on the number of the divacancy defects. In the case both the impurities are located on the edge, the magnitude of the exchange coupling is several orders of magnitude strengthen that result when they are placed on the interior of the nanoribbon. Furthermore, a periodic divacancy causes a dramatic change in the magnetic ground state of the ribbon. In the limit of high vacancy potential, the strength of the RKKY interaction is approximately independent of the Fermi energy.

cond-mat.mes-hall↗

arXiv2020

Strain and electric-field control of spin-spin interactions in monolayer CrI$_3$

We investigate the impact of mechanical strains and a perpendicular electric field on the electronic and magnetic ground-state properties of two-dimensional monolayer CrI$_3$ using density functional theory. We propose a minimal spin model Hamiltonian, consisting of symmetric isotropic exchange interactions, magnetic anisotropy energy, and Dzyaloshinskii-Moriya (DM) interactions, to capture most pertinent magnetic properties of the system. We compute the mechanical strain and electric field dependence of various spin-spin interactions. Our results show that both the amplitudes and signs of the exchange interactions can be engineered by means of strain, while the electric field affects only their amplitudes. However, strain and electric fields affect both the directions and amplitudes of the DM vectors. The amplitude of the magnetic anisotropy energy can also be substantially modified by an applied strain. We show that in comparison with an electric field, strain can be more efficiently used to manipulate the magnetic and electronic properties of the system. Notably, such systematic tuning of the spin interactions is essential for the engineering of room-temperature spintronic nanodevices.

cond-mat.mtrl-sci↗

arXiv2020

Mechanical properties of graphene oxide: the impact of functional groups

In the current study, mechanical characteristics of graphene oxide (GO) as a promising substitute of graphene are systematically studied through molecular dynamics simulation. For this purpose, several GO samples having different concentrations of epoxide and hydroxyl functional groups are considered. The results reveal that increasing the epoxide coverage causes a noticeable deterioration in the mechanical characteristics of GO systems. This change is correlated with the increase of the formation of ripples in the structure upon increasing the epoxide coverage. Moreover, investigating the bond lengths in the system, it is concluded that the higher epoxide percentage leads to an increase in the length of single and hybrid resonance bonds leading to an overall deterioration of the mechanical properties of GO samples. Additionally, our results demonstrate that high concentration of functional groups can lead to a negative Poisson ratio. Increasing the amount of hydroxyl groups shows the same declining effect on the Young modulus. In a graphene system containing both epoxide and hydroxyl groups, it is deduced that a higher percentage of the former can result in a higher residual strain because of the formation of more ripples within the system.

cond-mat.mtrl-sci↗

arXiv2020

Chiral Hall effect in strained Weyl semimetals

In this paper, the chiral Hall effect of strained Weyl semimetals without any external magnetic field is proposed. Electron-phonon coupling emerges in the low-energy fermionic sector through a pseudogauge potential. We show that, by using chiral kinetic theory, the chiral Hall effect appears as a response to a real time-varying electric field in the presence of structural distortion and it causes spatial chirality and charges separation in a Weyl system. We also show that the coupling of the electrons to acoustic phonons as a gapless excitation leads to emerging an optical absorption peak at $ω=ω_{el}$, where $ω_{el}$ is defined as a characteristic frequency associated with the pseudomagnetic field. We also propose the strain-induced planar Hall effect as another transport signature of the chiral-anomaly equation.

cond-mat.mtrl-sci↗

arXiv2020

Rotons and Bose condensation in Rydberg-dressed Bose Gases

We investigate the ground-state properties and excitations of Rydberg-dressed bosons in both three and two dimensions, using the hypernetted-chain Euler-Lagrange approximation, which accounts for correlations and thus goes beyond the mean field approximation. The short-range behavior of the pair distribution function signals the instability of the homogeneous system towards the formation of droplet crystals at strong couplings and large soft-core radius. This tendency to spatial density modulation coexists with off-diagonal long-range order. The contribution of the correlation energy to the ground-state energy is significant at large coupling strengths and intermediate values of the soft-core radius while for a larger soft-core radius the ground-state energy is dominated by the mean-field (Hartree) energy. We have also performed path integral Monte Carlo simulations to verify the performance of our hypernetted-chain Euler-Lagrange results in three dimensions. In the homogeneous phase, the two approaches are in very good agreement. Moreover, Monte Carlo simulations predict a first-order quantum phase transition from a homogeneous superfluid phase to the quantum droplet phase with face-centered cubic symmetry for Rydberg-dressed bosons in three dimensions.

cond-mat.quant-gas↗

arXiv2020

Plasmon-phonon-polaritons in encapsulated phosphorene

We consider a system consists of a doped monolayer phosphorene embedded between two hexagonal Boron Nitride (hBN) slabs along the heterostructure direction. The wavevector azimuthal angle dependence of the plasmon-polariton and plasmon-phonon-polariton modes of the hybrid system are calculated based on the random phase approximation at finite temperature. The collective modes illustrate strong anisotropy and strong coupling with phonon modes of the polar media and furthermore, the Landau damping occurs due to the intraband processes when plasmon enters intraband electron-hole continuum. Our numerical results show that the plasmon mode is highly confined to the surface along the zigzag direction. Owing to the strong electron-phonon interaction, the phonon dispersions in the Reststrahlen bands are also angle-dependent. These results are also in agreement with those of the semiclassical model obtained in our calculations.

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