A Tunable Perfect THz Metamaterial Absorber with Three Absorption Peaks Based on Nonstructured Graphene

In this paper, a graphene-based tunable multi-band terahertz absorber is proposed and numerically investigated. The proposed absorber can achieve perfect absorption within both sharp and ultra-broadband absorption spectra. This wide range of absorption is gathered through a unique combination of periodically cross- and square-shaped dielectrics sandwiched between two graphene sheets; the latter enables it to offer more absorption in comparison with the traditional single-layer graphene structures. The aforementioned top layer is mounted on a gold plate separated by a Topas layer with zero volume loss. Furthermore, in our proposed approach, we investigated the possibility of changing the shapes and sizes of the dielectric layers instead of the geometry of the graphene layers to alleviate the edge effects and manufacturing complications. In numerical simulations, parameters, such as graphene Fermi energy and the dimensions of the proposed dielectric layout, have been optimally tuned to reach perfect absorption. We have verified that the performance of our dielectric layout called fishnet, with two widely investigated dielectric layouts in the literature (namely, cross-shaped and frame-and-square). Our results demonstrate two absorption bands with near-unity absorbance at frequencies of 1.6–2.3 and 4.2–4.9 THz, with absorption efficiency of 98% in 1.96 and 4.62 THz, respectively. Moreover, a broadband absorption in the 7.77–9.78 THz is observed with an absorption efficiency of 99.6% that was attained in 8.44–9.11 THz. Finally, the versatility provided by the tunability of three operation bands of the absorber makes it a great candidate for integration into terahertz optoelectronic devices.

     

Staked Graphene for Tunable Terahertz Absorber with Customized Bandwidth

Terahertz (THz) absorber with dynamically tunable bandwidth possesses huge application value in the fields of switches, sensors, and THz detection. However, the perfect absorbers based on photonic crystals and metamaterials are not intelligent enough to capture the electromagnetic wave in a tunable way. In this paper, we utilized only patterned graphene to tune the absorption positions and the bandwidth in the terahertz regime. More distinguished than some dynamic absorbers proposed before, the performances with peak frequency relative tuning range of 68 % and nearly unity absorbance are obtained by a single cross-shaped graphene layer. Additionally, the working bandwidth can be broadened with stacked structured graphene. The almost perfect absorption shifted from 2.36～3.2 to 3.26～3.99 THz continuously via changing the chemical potential of graphene.     

Multi-layered Graphene Silica-Based Tunable Absorber for Infrared Wavelength Based on Circuit Theory Approach

Graphene can be utilized as a tunable material for a wide range of infrared wavelength regions due to its tunable conductivity property. In this paper, we use Y-shaped silver material resonator placed over the top of multiple graphene silica-layered structures to realize the perfect absorption over the infrared wavelength region. We propose four different designs by placing the graphene sheet over silica. The absorption and reflectance performance of the structures have been explored for 1500- to 1600-nm wavelength range. The proposed design also explores the absorption tunability of the structure for the different values of graphene chemical potential. We have reported the negative impedance for the perfect absorption for proposed metamaterial absorber structures. All the metamaterial absorbers have reported 99% of its absorption peaks in the infrared wavelength region. These designs can be used as a tunable absorber for narrowband and wideband applications. The proposed designs will become the basic building block of large photonics design which will be applicable for polariser, sensor, and solar applications.

     

Narrow-band enhanced absorption of monolayer graphene at near-infrared (NIR) sandwiched by dual gratings

One possibility of enhancing light absorption in monolayer graphene at near-infrared (NIR) wavelength region with grating structures is proposed and investigated. It is demonstrated that it is possible to achieve near-perfect absorption when a single monolayer graphene is sandwiched between two gratings with optimized geometric parameters at normal incidence for transverse electric (TE) polarization. By means of the rigorous coupled-wave analysis (RCWA), the effects of technological tolerances on the optical response of the structure by varying geometric parameters and incident angle are studied. The proposed photonic structure could be efficiently exploited as a building block for innovative optical absorbers or photodetectors in combination with active materials.     

A Research of Nonreciprocal Transmission of Graphene Defect

In this paper, modified transmission matrix method is used to construct one-dimensional multilayer composite membrane structure doped with graphene defect. The optimal construction can be found to realize reciprocity transmission by comparing the influence of the time inversion-symmetry and space inversion-symmetry doped on nonreciprocal transmission. The simulation results show that it cannot ensure the nonreciprocal transmission with rotatory material only. Nonreciprocal transmission should be designed through the structure damage of the space inversion-symmetry to realize it. The structure absorption peak position will move to the direction of the wavelength increase along with the increase of thickness of rotation media. The structure shows the approximate perfect absorption characteristics.     

Controlling Optical Absorption of Graphene in Near-infrared Region by Surface Plasmons

Nowadays, graphene has many applications in optical instruments, biosensors, gas sensors, photovoltaic cells, and so on. In this study, we aimed at investigating the optical properties of graphene under the influence of plasmons created in one-dimensional photonic crystal structure by making use of the absorption spectrum. We put the gold photonic crystal in adjacent to graphene and placed an antireflection layer on top of it. Then, we studied the behavior of graphene absorption peaks in a near-infrared region. By analyzing the graphene behavior in this region, we observed that graphene absorption was increased up to 40% and graphene absorption value in absorption peak, absorption peak wavelength, absorption spectra width, and also its absorption spectra in a wide wavelength range from 1000 to 2500 nm, could be controlled by making use of different factors such as the substance of antireflection layer and photonic crystal geometric dimensions. This structure can make many applications possible for graphene such as using it to build biosensors to identify uric acid and some of the lipids that have specific significances in detecting atherosclerotic lesions as well as diagnosing the states of disease.     

Wideband Graphene-Based Fractal Absorber and its Applications as Switch and Inverter

In this paper, the idea of square fractal geometry has been utilized to introduce a tunable wideband graphene-based perfect plasmonic absorber in the near-infrared region. It consists of a MgF₂ layer and an array of gold squares fractal loaded on a graphene layer. In the designed absorber a single layer of graphene has been used instead of multilayered graphene structures. The structure is polarization-insensitive under normal incidence due to the geometric symmetry. The absorption and bandwidth of the structure are almost insensitive to the incident angle up to 15° and 45° for TE and TM polarizations, respectively. Moreover, by choosing appropriate structural parameters, the resonance wavelength of the desired plasmonic absorber can be controlled. The absorption of the introduced structure can be tuned by changing the chemical potential of the graphene. Therefore, the proposed fractal absorber can act as switch and inverter at λ = 1995 nm. Furthermore, the equivalent circuit model of the absorber has been derived to confirm the validity of the simulation results. The superiorities of our fractal absorber are wide full-width at half-maximum of 406 nm, multi-applicant, perfect absorption, and fabrication feasibility due to the simple structure with the maximum absorption tolerance error of 5.12%.

     

Tunable Extraordinary Transmission through a Graphene-Covered Hole Array: an Analytical Equivalent-Circuit Modeling Approach

Plasmonics - We study two-dimensional (2D) hole arrays drilled into a perfect conductor slab covered with a graphene sheet. Such arrays support the extraordinary transmission of electromagnetic...     

Tunable Terahertz Plasmonic Perfect Absorber Based on T-Shaped InSb Array

High absorption efficiency is particularly desirable for various microtechnological applications. In this paper, a nearly perfect terahertz absorber for transverse magnetic (TM) polarization based on T-shaped InSb array is proposed and numerically investigated. Incident wave at the Fabry-Perot resonant frequency can be totally absorbed into the narrow grooves between the two adjacent T-shaped InSb arms. The absorption mechanism is theoretically and numerically studied by using the Fabry-Perot model and the finite element method (FEM), respectively. It is found that the proposed absorber has large angle tolerance. Moreover, the absorption peak can be controlled by varying the temperature. Furthermore, a new absorption peak will emerge while breaking the symmetry of the T-shaped InSb array. This tunable and angle-independent THz perfect absorber may find important applications in THz devices such as microbolometers, coherent thermal emitters, solar cells, photo detectors, and sensors.     

Modulation of Visible and Near-Infrared Surface Plasmon Resonance of Au Nanoparticles Based on Highly Doped Graphene

We study an active modulation of surface plasmon resonance (SPR) of Au nanoparticles based on highly doped graphene in visible and near-infrared regions. We find that compared to the traditional metal SPR, the SPR of Au nanoparticles based on graphene causes a remarkable blue shift. The field intensity in the gap is redistributed to standing wave. The field intensity of standing wave is about one order of magnitude higher than the traditional model. Moreover, the SPR of Au nanoparticles can be actively modulated by varying the graphene Fermi energy. We find the maximum modulation of field intensity of absorption spectra is more than 21.6 % at λ?=?822?nm and the amount of blue shift is 17.4 nm, which is about 2.14 % of the initial wavelength λ ₀?=?813.4?nm, with increasing monolayer graphene Fermi energy from 1.0 to 1.5 ev. We find that the SPR sensitivity to the refractive index n of the environment is about 642 nm per refractive index unit (RIU). The SPR wavelengths have a big blue shift, which is about 33 nm, with increasing number of graphene layers from 1 to 3, and some shoulders on the absorption spectra are observed in the models with multilayer graphene. Finally, we study the Au nanorod array based on monolayer graphene. We find that the blue shift caused by the graphene increases from 14 to 24 nm, with increasing gap g _y from 10 to 20 nm. Then, it decreases from 24 to 14 nm, with increasing gap g _y from 20 to 50 nm. This study provides a new way for actively modulating the optical and optoelectronic devices.     

Wrinkling and thermal conductivity of one graphene sheet under shear

Tersoff-potential - based molecular dynamics method is used to simulate wrinkling deformation of one graphene sheet under shear, and the obtained deformation is compared with analytical solutions of macro-membrane. Furthermore, thermal conductivity of the wrinkled graphene at different temperatures is calculated. It is found that (1) the wrinkling deformation of graphene sheet under shear is close to the analytical solutions of macro-membrane under shear, which implies that the solutions of macro-membrane are applicable to predict the wrinkling deformation of graphene sheets under shear; (2) the more serious the wrinkling of the graphene under shear is, the stronger the phonon scattering is and, therefore, the lower the thermal conductivity of the wrinkled graphene is; (3) within the temperature range of 400–700 K, the thermal conductivity of graphene sheet decreases with increase in temperature.     

Mechanical properties of pristine and nanoporous graphene

We present molecular dynamics simulations of monolayer graphene under uniaxial tensile loading. The Morse, bending angle, torsion and Lennard-Jones potential functions are adopted within the mdFOAM library in the OpenFOAM software, to describe the molecular interactions in graphene. A well-validated graphene model using these set of potentials is not yet available. In this work, we investigate the accuracy of the mechanical properties of graphene when derived using these simpler potentials, compared to the more commonly used complex potentials such as the Tersoff-Brenner and AIREBO potentials. The computational speed up of our approach, which scales O(1.5N), where N is the number of carbon atoms, enabled us to vary a larger number of system parameters, including graphene sheet orientation, size, temperature and concentration of nanopores. The resultant effect on the elastic modulus, fracture stress and fracture strain is investigated. Our simulations show that graphene is anisotropic, and its mechanical properties are dependant on the sheet size. An increase in system temperature results in a significant reduction in the fracture stress and strain. Simulations of nanoporous graphene were created by distributing vacancy defects, both randomly and uniformly, across the lattice. We find that the fracture stress decreases substantially with increasing defect density. The elastic modulus was found to be constant up to around 5% vacancy defects, and decreases for higher defect densities.     

Quadratic Dispersion and Damping Processes of π Plasmon in Monolayer Graphene on Pt(111)

High-resolution electron energy-loss spectroscopy has been used to study the π plasmon in monolayer graphene grown on Pt(111). A quadratic dispersion has been observed, in contrast to the linear dispersion reported for monolayer graphene grown on SiC(0001) and in agreement with recent experiments on graphene/Ni(111). Despite the weak interaction of the monolayer graphene with the Pt(111) surface, our results indicate that the screening by the underlying metal substrate strongly influences both the dispersion relation and the damping processes of the plasmon mode of π electrons.     

First principle study of cysteine molecule on intrinsic and Au-doped graphene surface as a chemosensor device

To search for a high sensitivity sensor for cysteine, we investigated the adsorption of cysteine on intrinsic and Au-doped graphene sheets using density functional theory calculations. Binding energy is primarily determined by the type of atom which is closer to the adsorbed sheet. Compared with intrinsic graphene, Au-doped graphene system has higher binding energy value and shorter connecting distance, in which strong Au-S, Au-N and Au-O chemical bond interaction play the key role for stability. Furthermore, the density of states results show orbital hybridization between cysteine and Au-doped graphene sheet, but slight hybridization between the cysteine molecule and intrinsic graphene sheet. Large charge transfers exist in Au-doped graphene-cysteine system. The results of DOS and charge transfer calculations suppose that the electronic properties of graphene can be tuned by the adsorption site of cysteine. Therefore, graphene and Au-doped graphene system both possess sensing ability, except that Au-doped graphene is a better sensor for cysteine than intrinsic graphene.     

Chemical functionalization of graphene via aryne cycloaddition: a theoretical study

Chemical functionalization of graphene provides a promising route to improve its solubility in water and organic solvents as well as modify its electronic properties, thus significantly expanding its potential applications. In this article, by using density functional theory (DFT) methods, we have studied the effects of the chemical functionalization of graphenes via aryne cycloaddition on its properties. We found that the adsorption of an isolated aryne group on the graphene sheet is very weak with the adsorption energy of -0.204 eV, even though two new single C-C interactions are formed between the aryne group and the graphene. However, the interaction of graphene with the aryne group can be greatly strengthened by (i) substituting the H-atoms in aryne group with F-, Cl-, -NO(2) (electron-withdrawing capability), or CH(3)-group (electron-donating capability), and (ii) increasing the coverage of the adsorbed aryne groups on the graphene sheet. As expected, the strongest bonding is found on the graphene edges, in which the adsorbed aryne groups prefer to be far away from each other. Interestingly, chemical functionalization with aryne groups leads to an opening of the band gap of graphene, which is dependent on the coverage of the adsorbed aryne groups. The present work provides an insight into the modifications of graphene with aryne groups in experiment.     

Coarse-grained molecular simulation of self-assembly nanostructures of CTAB on nanoscale graphene

Coarse-grained molecular dynamics simulation has been performed to study the aggregated morphology of the cationic surfactant, cetyltrimethylammonium bromide (CTAB), adsorbed on nanoscale graphene surfaces. The CTAB surfactants can self-assemble on graphene to form various supramolecular morphologies and structures. The effect of packing density, thickness of graphene sheet and width of graphene nanoribbon on the CTAB–graphene self-assembly has been investigated. The buoyant densities of various graphene–CTAB assemblies were calculated, which increase with surfactant coverage and number of graphene layers. This result demonstrates that density gradient can be used to isolate graphenes with various layers. This simulation provides larger-scale microscopic insight into the supramolecular self-assembly nanostructures for the CTAB surfactants aggregated on graphene, which could be valuable to guide fabrication of graphene-based hybrid nanocomposites.     

Tunable and Multichannel Terahertz Perfect Absorber Due to Tamm Plasmons with Topological Insulators

In this paper, Tamm plasmons with topological insulators in a composite structure consisting of Bi₂Se₃, spacer layer, and one-dimensional photonic crystal (1DPC) have been demonstrated theoretically. The perfect absorption has been realized in the terahertz regime because of the optical Tamm states (OTSs) excited at the interface between Bi₂Se₃ and 1DPC. The perfect absorption can be realized for both TE and TM waves, and it is noted that the perfect absorption can be obtained at any incident angle by simultaneously changing the wavelength of incident light for TE-polarizations. Moreover, the perfect absorption can be realized at different wavelengths with the change of the chemical potential and the thickness of Bi₂Se₃. The thickness and the dielectric constant of the spacer layer will also play a vital role in the performance of the perfect absorber. Especially, the multichannel perfect absorption phenomenon can be achieved by choosing the appropriate thickness of the spacer layer. This tunable and multichannel terahertz perfect absorber has great application potential in the solar energy, photodetection, and THz biosensor.

     

An Ultra-Wideband Terahertz Metamaterial Absorber Utilizing Sinusoidal-Patterned Dielectric Loaded Graphene

In this paper, a non-structured graphene sheet loaded with a sinusoidal-patterned dielectric is introduced as an ultra-wideband metamaterial absorber in terahertz regime. Regardless of conventional structures with multilayered-graphene, a single layer sheet of non-structured graphene is used whereas the proposed structure benefits from dielectric width modulation and cavity method in order to excite continuous graphene plasmon resonances. The structure comprises four layers that two Fabry-Perot cavity mirrors are constructed by upper sinusoidal-patterned dielectric and a gold film. Full wave simulation results demonstrate that a broadband over 90% absorption with absolute bandwidth of 6.58 THz and central frequency of 3.97 THz is achieved under normal TE/TM incident plane wave. The designed structure yields 166% relative bandwidth. According to the symmetric configuration, the absorption spectra of mentioned polarizations are thoroughly close to each other resulting to a polarization insensitive structure. The stability of bandwidth and absorbance of the structure versus angle of incidence, θ, up to 35°/65° for TM/TE polarizations, respectively, and azimuth angle, φ, shows an interesting capability for utilization as detectors and sensors. The simple geometry of utilized graphene layer results in easy fabrication. The designed structure has wideband absorption in THz regime. Moreover, it is more compact than conventional broadband THz absorbers.

     

Broadband Terahertz Absorption in Graphene-Embedded Photonic Crystals

The absorption in graphene is rather low at terahertz frequencies. Here, we present a graphene-embedded photonic crystal structure to realize broadband terahertz absorption in graphene. The approach provides absorption enhancement in the whole terahertz regime (from 0.1 to 10 THz). It is shown that the average absorption in the graphene-embedded photonic crystal can be enhanced in the multiple propagating bands of the photonic crystals. The absorption efficiency can be further improved by optimizing the characteristic frequency, optical thickness ratio in a unit cell, and the angle of incidence on the photonic crystals. A maximum broadband absorption factor of 28.8% was achieved for fixed alternative dielectric materials. The graphene-embedded photonic crystal is promising for terahertz functional devices with broadband response.     

Si-doped graphene: an ideal sensor for NO- or NO<Subscript>2</Subscript>-detection and metal-free catalyst for N<Subscript>2</Subscript>O-reduction

Exploring and evaluating the potential applications of two-dimensional graphene is an increasingly hot topic in graphene research. In this paper, by studying the adsorption of NO, N₂O, and NO₂ on pristine and silicon (Si)-doped graphene with density functional theory methods, we evaluated the possibility of using Si-doped graphene as a candidate to detect or reduce harmful nitrogen oxides. The results indicate that, while adsorption of the three molecules on pristine graphene is very weak, Si-doping enhances the interaction of these molecules with graphene sheet in various ways: (1) two NO molecules can be adsorbed on Si-doped graphene in a paired arrangement, while up to four NO₂ molecules attach to the doped graphene with an average adsorption energy of −0.329 eV; (2) the N₂O molecule can be reduced easily to the N₂ molecule, leaving an O-atom on the Si-doped graphene. Moreover, we find that adsorption of NO and NO₂ leads to large changes in the electronic properties of Si-doped graphene. On the basis of these results, Si-doped graphene can be expected to be a good sensor for NO and NO₂ detection, as well as a metal-free catalyst for N₂O reduction.