Monolayer Samples Research Articles

Element-specific X-Ray detection of electron paramagnetic resonance in thin films of quantum bits

Element-specific magnetism accessible by synchrotron-based X-ray spectroscopy has proven to be valuable to study spin and orbital moments of transition metals and lanthanides in technologically relevant thin-film and monolayer samples. The access to coherent spin superposition states relevant for emergent quantum technologies remains, however, elusive with ordinary X-ray spectroscopy. Here, we approach the study of such quantum-coherent states via the X-ray detection of microwave-driven electron paramagnetic resonance, which involves much smaller signal levels than X-ray detected ferromagnetic resonance on classical magnets. We demonstrate the feasibility of this approach with thin films of phthalocyanine-based metal complexes containing copper or vanadium centers. We also identify X-ray specific phenomena that we relate to charge trapping of secondary electrons resulting from the decay of the X-ray excited core-hole state. Our findings pave the way toward the element-specific X-ray detection of coherent superposition states in monolayers of atomic and molecular spins on virtually arbitrary surfaces.

Unveiling charge transport in monolayer and few-layer CoPS3/metal contact: Insight from C-AFM

Monolayer and few-layer CoPS3 have been successfully synthesized via an Au-assisted exfoliation technique, with their transport properties subsequently investigated by conductive atomic force microscopy. Rectification effects can be observed in CoPS3 nanosheets due to the Schottky junction formation at the Au/CoPS3 interface, especially in configurations comprising two or more layer flakes. The distinct transport properties between monolayer and few-layer samples demonstrate that the charge transport behavior in the vertical direction is associated with the van der Waals gap. The calculated electron affinity for CoPS3 is about 4.84 eV, as revealed by the thermionic emission model. The results obtained contribute to the knowledge base concerning the transport characteristics of ultrathin MPX3, facilitating further exploration of the transport behavior of these materials and their potential applications in novel electronic devices.

High‐β Lasing in Self‐Assembled Photonic‐Defect Microcavities with a Transition Metal Dichalcogenide Monolayer as Active Material

AbstractThe investigation and development of innovative micro‐ and nanolasers using transition metal dichalcogenide (TMDC) monolayers as active materials is attracting considerable attention due to their unique electrical, mechanical, and optical properties. In this report, the fabrication of photonic‐defect microcavities that are self‐assembled and integrated into a dielectric distributed Bragg reflector structure that fully encapsulates a monolayer of tungsten diselenide () is detailed. The encapsulation process of the monolayer with hexagonal boron nitride generates air bubbles that induce parabolic photonic defects in the microcavity. These defects lead to a tight diameter‐dependent three‐dimensional optical confinement, which is confirmed by experimental studies and numerical simulations. In addition, a significant nonlinearity in the input‐output characteristics and excitation‐power‐dependent linewidth narrowing is observed in the resonators, indicating laser operation, which is verified by photon autocorrelation measurements. The photonic‐defect cavities are all formed on a single monolayer sample, suggesting potential advantages for multi‐wavelength emission photonic applications and facilitating TMDC‐based prestructured photonic‐defect microlasers for large‐scale fabrication.

Analysis of peculiarities of polymer matrix microstructure in PCMs formed under the influence of electrophysical effects

The microstructure of monolayer samples formed by 3D printing from composite prepregs reinforced with continuous carbon fiber, followed by treatment in a cured state by exposure to ultrasonic vibrations and a microwave electromagnetic field, has been studied. It has been shown that high-power ultrasonic exposure causes macro-changes, which are characterized by a decrease in the number and transverse dimensions of delaminations (cracks) from 0.05–0.1 mm to 0.01–0.02 mm and a decrease in the height of microrelief elements by almost an order of magnitude. Changes caused by exposure to a microwave electromagnetic field are more apparent when examining the end surface with an increase from ×1000 to ×10000. The control samples revealed fibers consolidated by binder in combination with unfilled gaps in a ratio of about 50:50, with individual globular fragments of frozen binder on their surface. The samples after microwave exposure revealed the presence of large areas without defects, completely uniformly filled with binder, fibers from all sides are in contact with the binder, in which there are voids no larger than 5 × 1.5μm in size. Greater orderliness of the structure of monolayers is most typical for samples with two-stage processing, including preliminary ultrasonic and subsequent.

Modeling the coverage of MoS2 and WS2 thin films using in-situ spectroscopic ellipsometry

In-situ spectroscopic ellipsometry (SE) was used to analyze monolayer and few-layer samples of molybdenum disulfide (MoS2) and tungsten disulfide (WS2) grown by metalorganic chemical vapor deposition (MOCVD) on sapphire substrates. MoS2 and WS2 film growth times ranged from 5 – 40 min to achieve a range of film coalescence and surface coverage from less than a monolayer to considerable bilayer and additional layers. Post-growth measurements using atomic force microscopy, photoluminescence and Raman spectroscopy were used to assess the evolution of surface morphology and film properties with growth time to determine the areal coverage of monolayer, bilayer, multilayer and void regions. The room temperature SE spectra were modeled using an effective medium approximation to obtain the monolayer and bilayer dielectric functions of MoS2 and WS2. Using these distinct dielectric functions, changes in ellipsometry parameters associated with partial to full coverage of monolayers and bilayers were simulated. Such simulations will enable improved control of the layer-by-layer deposition of MoS2 and WS2 by monitoring in-situ spectroscopic ellipsometry.

Resonant Raman Scattering Study of Strain and Defects in Chemical Vapor Deposition Grown MoS2 Monolayers.

The development of bottom-up synthesis routes for semiconducting transition metal dichalcogenides (TMDs) and the assessment of their defects are of paramount importance to achieve their applications. TMD monolayers grown by chemical vapor deposition (CVD) can be subjected to significant strain and, here, Raman and photoluminescence spectroscopies are combined to characterize strain in over one hundred MoS2 monolayer samples grown by CVD. The frequency changes of phonons as a function of strain are analyzed, and used to extract the Grüneisen parameter of both zone-center and edge phonons. Additionally, the intensity of the defect-induced longitudinal acoustic (LA) and transverse acoustic(TA) Raman bands are discussed in relation to strain and electronic doping. The experimental mode-Grüneisen parameters obtained are compared with those calculated by density functional theory (DFT), to better characterize the type of strain and its resulting effects on Grüneisen parameters. The findings indicate that the use of Raman spectra to determine defect densities in 2D MoS2 must be always conducted considering strain effects. To the best of the authors' knowledge, this work constitutes the first report on double resonance Raman processes studied as a function of strain in 2D-MoS2. The new approach to obtain the Grüneisen parameter from zone-edge phonons in MoS2 can also be extended to other 2D semiconducting TMDs.

Enhancing solar-driven atmospheric water harvesting by a bilayer macroporous hydrogel

The adsorption-based atmospheric water harvesting technique has shown great potential in providing clean water. An ideal device for atmospheric water harvesting should enable the massive and quick release of water after it is rapidly absorbed by the moisture adsorbent. At present, however, the moisture adsorbent still experiences issues such as a slow water absorption rate, hampered adsorption–desorption kinetics, and a low total water yield. In this paper, a bilayer moisture adsorbent (BMA), which glues a hydrophilic macroporous layer for rapid water adsorption and a carbonized sunlight-absorbing layer for both water harvesting and desorption acceleration, is introduced. Further evidence suggests that it is the stable, fluffy, and rough porous structure of the BMA that helps to harvest atmospheric water efficiently. The fully carbonized BMA exhibits a water absorption capacity of up to 396% at a relative humidity of 90%, which is 20% higher than a monolayer sample. More importantly, the desorption efficiency of the half-carbonized BMA reaches 98% under 1 sun illumination. These results jointly demonstrate that the BMA can play the dual role of absorbing moisture and light, allowing for rapid atmospheric water harvesting, massive water storage, and efficient desorption under the light.

Novel deposition method for gold and platinum nanoparticles on silicon substrates utilizing poly (ethylene glycol) 6000 for MEIS analysis

The use of nanoparticles has significantly increased in many areas, such as biomedical research, being highly useful as nanoprobes for imaging and as nanocarriers for drug delivery applications. Nevertheless, this potential can only be achieved with the correct characterization of the nanoparticles, since their size and shape can directly affect their biological behavior. In this study, we propose a novel approach for a monolayer deposition of gold and platinum nanoparticles on Si substrates suitable for medium energy ion scattering (MEIS) analysis. The samples were prepared using poly(ethylene glycol) 6000 (PEG 6000) as a coating agent for the substrates, utilizing a spin coater-a versatile, cost-effective, and practical technique. The samples were first analyzed with the RBS technique to assess the adhesion and the overlapping of the nanoparticles in the substrates coated with PEG 6000 and then characterized through the MEIS technique. The analysis through MEIS allowed the determination of the shape, size, and coverage area of the nanoparticles. Scanning and transmission electron microscopy were also performed on the samples, with the results corroborating the findings of the MEIS experiment. Together, the data obtained with microscopy and the MEIS technique suggests the effectiveness of the method in the production of monolayer samples.

High-density polyethylene (HDPE)-incorporated boron carbide and boric acid nanoparticles as a nanoshield of photoneutrons from medical linear accelerators

Purpose The current study aimed to investigate boron carbide and boric acid nanoparticles (NPs) as absorbents for thermal neutrons and high-density polyethylene (HDPE) as a substrate and neutron moderator for fast neutrons. The goal was to assess the performance of boron carbide and boric acid NPs based on HDPE as a nanoshield of photoneutrons from medical linear accelerators. Materials and methods This study was conducted in two parts of simulation and practice. The Monte Carlo (MC) simulation involved modeling and verification of the single-layer, double-layer, and combined nanoshields by selecting nanomaterials and substrates and, finally, calculating the macroscopic cross-sections. The practical part involved manufacturing nanoshields based on the simulation results and evaluating the manufactured nanocomposites via experimental measurements. Results MC simulation results with an uncertainty of less than 1% showed that for the monolayer samples, the best result belonged to boron carbide at a concentration of 10% and a macroscopic cross-section of 0.933 cm–1. At a concentration of 20%, the highest value among the double-layer samples was 0.936 cm–1 and for the combined samples, this value was 0.928 cm–1. Boron carbide single-layer nanocomposites at a 10% concentration, as well as the bilayer nanoshield of 10% boron carbide and 20% boric acid performed well; however, the best performance belonged to the nanoshield with a macroscopic cross-section of 0.960 and the combination containing 5% boron carbide and 10% boric acid. Conclusions The research suggests that utilizing boron carbide and boric acid nanoshields in combination with HDPE holds promise as a viable approach to protecting from the photoneutrons. Further exploration of these nanocomposite shields and their practical applications is warranted, with the potential to yield significant advancements in radiation therapy safety and efficacy.

A theoretical study of Lifshitz transition for 2H-TaS2.

Lifshitz transition was proposed to explain a change of the topology structure in a Fermi surface induced by continuous lattice deformation without symmetry breaking since 1960. It is well known that the anomalies of the kinetic coefficients (the coefficient of heat conduction and electrical conductivity, viscosity, sound absorption, etc.) are usually closely connected with the Lifshitz transition behavior. 2H-TaS2 is a typical representative to study its anomalies of temperature dependence of heat capacity, resistivity, Hall effect, and magnetic susceptibility. Its geometrical structure of the charge density wave (CDW) phase and layer number dependence of carrier-sign alternation upon cooling in the Hall measurements have not been well understood. The geometrical structure (T-Ts) of the CDW phase was predicted through first principles calculations for bulk and mono-layer 2H-TaS2. Driven by electron-lattice coupling, Ta atoms contract to form a partially gapped CDW phase. The CDW phase has a larger average interlayer separation of S-S atoms in the adjacent two layers compared with the metal phase, which results in a weaker chemical bonding among S-S atoms in the adjacent two layers and then a narrower bandwidth of the energy band. The narrower bandwidth of the energy band leads to a larger density of states (DOS) in the out-of-plane direction above the Fermi level for the CDW phase. As the Fermi level continually drops from the DOS region with a negative slope to that with a positive slope on cooling, the reversal of the p → n type carrier and the pocket-vanishing-type Lifshitz transition occur in the bulk 2H-TaS2. However, the Fermi level slightly drops by 6 meV and happens to be at the positions of pseudo band gaps, so the reduction of in-plane DOS and total DOS is responsible for the always p-type carrier in the mono-layer samples. Our CDW vector of the k-space separation between two saddle points is QSP ≈ 0.62 GK and can provide a theoretical support for the "saddle-point" CDW mechanism proposed by Rice and Scott. Our theoretical explanation gives a new understanding of both Lifshitz transition for symmetry breaking and reversal for the p-n carrier sign in the Hall measurements in various two-dimensional transition metal disulfides.

Validating the Use of Conductive Atomic Force Microscopy for Defect Quantification in 2D Materials.

Defects significantly affect the electronic, chemical, mechanical, and optical properties of two-dimensional (2D) materials. Thus, it is critical to develop a method for convenient and reliable defect quantification. Scanning transmission electron microscopy (STEM) and scanning tunneling microscopy (STM) possess the required atomic resolution but have practical disadvantages. Here, we benchmark conductive atomic force microscopy (CAFM) by a direct comparison with STM in the characterization of transition metal dichalcogenides (TMDs). The results conclusively demonstrate that CAFM and STM image identical defects, giving results that are equivalent both qualitatively (defect appearance) and quantitatively (defect density). Further, we confirm that CAFM can achieve single-atom resolution, similar to that of STM, on both bulk and monolayer samples. The validation of CAFM as a facile and accurate tool for defect quantification provides a routine and reliable measurement that can complement other standard characterization techniques.

Atomic Force Microscopy-Based Nanoscale Infrared Techniques for Catalysis.

Atomic force microscopy (AFM)-based nanoscale infrared (nano-IR) techniques have found extensive application in the fields of chemistry, physics, and materials science, enabling the visualization of nanoscale features that surpass the optical diffraction limit. More recently, tentative investigations have been conducted into the use of these techniques in the field of catalysis, particularly in studying interfacial processes involving molecular monolayer samples. IR nanoimaging and nanospectroscopy offer unique perspectives on catalytic processes. Considering the specific characteristics of catalytic processes, this Perspective highlights the need for and reviews the current status of AFM-based nano-IR techniques for catalysis investigations, which aims to contribute to a deeper understanding of the nanoscale mechanisms underlying the catalytic processes.

Utilizing two-dimensional monolayer and three-dimensional spheroids to enhance radiotherapeutic potential by combining gold nanoparticles and docetaxel

BackgroundMuch in vitro research on the applicability of gold nanoparticles (GNPs) in cancer treatment has been focused on two-dimensional (2D) monolayer models. To improve this, we explored the effect of the combination of GNPs and docetaxel (DTX) with radiotherapy (RT) in a more complex three-dimensional (3D) spheroid that can better mimic a real tumour microenvironment.MethodsTwo cell lines, prostate cancer LNCaP and cervical cancer HeLa, were grown in monolayer and spheroids. Cells were dosed with GNPs at a concentration of 10 mathrm{mu g}/mathrm{mL} and with DTX at a dose that inhibited growth-rate by 50%. Samples were irradiated 24 h after drug dosing with 2 Gy, 5 Gy, or 10 Gy using a 6 MV beam. Monolayer cells had the DNA double-strand breaks (DSBs) probed 24 h post-radiation, and cell proliferation observed over 7 days. Spheroid proliferation was monitored over 14 days along with spheroid volume measurements.ResultsIn DTX and GNP-treated monolayer samples, there is decreased survival after irradiation with 5 and 10 Gy of 16–24% and an increase in DSBs of 91.6–109.9%, compared to DTX. In spheroids, GNPs decreased the surviving cells by 10.54–15.61% compared to control, while GNPs and DTX decreased survival by 20.9–31.04%. There is reduced spheroid volume 14 days after treatment with the triple combination.ConclusionsCombining GNPs and DTX leads to a synergistic radiosensitization effect in spheroids, which can better mimic the tumour microenvironment. Testing treatment modalities with spheroids and RT may allow a quicker translation to the clinic.

A Comparative Study of Electronic, Optical, and Thermoelectric Properties of Zn-Doped Bulk and Monolayer SnSe Using Ab Initio Calculations.

In this study, we explore the effects of Zn doping on the electronic, optical, and thermoelectric properties of α-SnSe in bulk and monolayer forms, employing density functional theory calculations. By varying the doping concentrations, we aim to understand the characteristics of Zn-doped SnSe in both systems. Our analysis of the electronic band structure using (PBE), (SCAN), and (HSE06) functionals reveals that all doped systems exhibit semiconductor-like behavior, making them suitable for applications in optoelectronics and photovoltaics. Notably, the conduction bands in SnSe monolayers undergo changes depending on the Zn concentration. Furthermore, the optical analysis indicates a decrease in the dielectric constant when transitioning from bulk to monolayer forms, which is advantageous for capacitor production. Moreover, heavily doped SnSe monolayers hold promise for deep ultraviolet applications. Examining the thermoelectric transport properties, we observe that Zn doping enhances the electrical conductivity in bulk SnSe at temperatures below 500 K. However, the electronic thermal conductivity of monolayer samples is lower compared to bulk samples, and it decreases consistently with increasing Zn concentrations. Additionally, the Zn-doped 2D samples exhibit high Seebeck coefficients across most of the temperature ranges investigated.

Improvement of the thermoelectric performance of boron-doped silicon by blocking minority carrier diffusion on the p+/p interface

Abstract A two-layer bulk Si material with different boron concentrations was prepared using spark plasma sintering to improve its thermoelectric performance by blocking minority carrier diffusion across its interfaces. The sintered two-layer sample (p+/p-Si) was cut to include the interface. Two monolayer samples (p+-Si, p-Si) were prepared for comparison. Seebeck coefficient mapping of the p+/p-Si surface by thermal probing confirmed a Seebeck coefficient gap between the two p-type Si layers, indicating that a band offset exists at the interface. When compared with the average resistivities and voltages for p+-Si and p-Si, the electrical resistivity in the p+/p-Si sample is almost identical, but the thermoelectric voltage is higher when the p+-part is heated more than the p-part. This indicates that bipolar carrier transport inhibition in the band offset improved the thermoelectric voltage. This bandgap engineering process and principle can be extended to other thermoelectric materials that can be processed via powder sintering.

Development of an efficient bi-layer absorber based on WSe2 and LaCoO3 nanopowders for X-band frequency: Computational and experimental validation

Herein, monolayer and bilayer absorbers were designed to investigate the microwave absorption characteristics of LaCoO3 and WSe2 nanomaterials. WSe2 monolayer sample showed better absorption capabilities as compared to LaCoO3 single-layer sample. The microwave absorption effectiveness of bilayer absorbents was scrutinized using a simulation approach. The simulation results demonstrated that a bilayer absorber composed of LaCoO3 as the bottom layer (0.5 mm thickness) and WSe2 on the top layer (1.5 mm thickness) can obtain a minimum reflection loss (RLmini) of −42.5 dB with an effective absorption bandwidth (EAB) of 2.8 GHz (12.4 GHz–9.6 GHz) at 10.8 GHz. Simulation predictions and experimental findings were juxtaposed; which accord with one another quite well. The findings demonstrate that the exceptional microwave absorption performance of the bilayer absorber may be attributed to its layered architecture. Our study presents a simple synthetic method and new perspectives on engineering a bilayer absorber with simulation and experimental justification.

Revealing the two-dimensional electronic structure and anisotropic superconductivity in a natural van der Waals superlattice (PbSe) 1.14NbSe2

Van der Waals superlattices are important for tailoring the electronic structures and properties of layered materials. Here we report the superconducting properties and electronic structure of a natural van der Waals superlattice (${\mathrm{PbSe})}_{1.14}{\mathrm{NbSe}}_{2}$. Anisotropic superconductivity with a transition temperature ${T}_{c}$ = 5.6 $\ifmmode\pm\else\textpm\fi{}$ 0.1 K, which is higher than monolayer ${\mathrm{NbSe}}_{2}$, is revealed by transport measurements on high-quality samples. Angle-resolved photoemission spectroscopy (ARPES) measurements reveal the two-dimensional electronic structure and a charge transfer of 0.43 electrons per ${\mathrm{NbSe}}_{2}$ unit cell from the blocking PbSe layer. In addition, polarization-dependent ARPES measurements reveal a significant circular dichroism with opposite contrast at K and ${\mathrm{K}}^{\ensuremath{'}}$ valleys, suggesting a significant spin-orbital coupling and distinct orbital angular momentum. Our work suggests natural van der Waals superlattice as an effective pathway for achieving intriguing properties distinct from both the bulk and monolayer samples.

Comparative Study between Sulfurized MoS2 from Molybdenum and Molybdenum Trioxide Precursors for Thin-Film Device Applications.

Two-dimensional (2D) materials have been studied as an emerging class of nanomaterials owing to their attractive properties in nearly every field of science and technology. Molybdenum disulfide (MoS2) is one of the more promising candidates of these atomically thin 2D materials for its technological potential. The facile synthesis of MoS2 remains a matter of broad interest. In this study, MoS2 was synthesized by chemical vapor deposition sulfurization at various temperatures (550 °C, 650 °C, and 750 °C) of either precursor molybdenum metal (Mo) or molybdenum trioxide (MoO3) deposited on silicon/silicon dioxide (Si/SiO2) via e-beam evaporation. Monolayer, bilayer, and few layers sulfurized samples have been grown and verified by Raman, photoluminescence spectroscopy, XRD, XPS, and AFM. MoO3 sulfurization provided monolayer growth in comparison to Mo sulfurization under the same conditions and precursor thicknesses. Optical microscopy showed the homogeneous nature of grown samples. A main finding of this work is that MoO3 sulfurization produced higher quality MoS2 as compared to those grown by an Mo precursor. Device characteristics based on monolayer MoO3 sulfurized MoS2-x include nonvolatile resistive switching with Ion/Ioff ≈ 104 at a relatively low operating bias of ±1 V. In addition, field-effect transistor characteristics revealed p-type material growth with a carrier mobility ∼ 41 cm2 V-1 s-1, which is in contrast to typically observed n-type characteristics.

Shift current photovoltaic efficiency of 2D materials

Shift current photovoltaic devices are potential candidates for future cheap, sustainable, and efficient electricity generation. In the present work, we calculate the solar-generated shift current and efficiencies in 326 different 2D materials obtained from the computational database C2DB. We apply, as metrics, the efficiencies of monolayer and multilayer samples. The monolayer efficiencies are generally found to be low, while the multilayer efficiencies of infinite stacks show great promise. Furthermore, the out-of-plane shift current response is considered, and material candidates for efficient out-of-plane shift current devices are identified. Among the screened materials, MXY Janus and MX2 transition metal dichalchogenides (TMDs) constitute a prominent subset, with chromium based MXY Janus TMDs holding particular promise. Finally, in order to explain the band gap dependence of the PV efficiency, a simple gapped graphene model with a variable band gap is established and related to the calculated efficiencies.

Fabrication of Mechanically Enhanced, Suturable, Fibrous Hydrogel Membranes.

Poly(vinyl-alcohol) hydrogels have already been successfully utilised as drug carrier systems and tissue engineering scaffolds. However, lacking mechanical strength and suturability hinders any prospects for clinical and surgical applications. The objective of this work was to fabricate mechanically robust PVA membranes, which could also withstand surgical manipulation and suturing. Electrospun membranes and control hydrogels were produced with 61 kDa PVA. Using a high-speed rotating cylindrical collector, we achieved fibre alignment (fibre diameter: 300 ± 50 nm). Subsequently, we created multilayered samples with different orientations to achieve multidirectional reinforcement. Finally, utilising glutaraldehyde as a cross-linker, we created insoluble fibrous-hydrogel membranes. Mechanical studies were performed, confirming a fourfold increase in the specific loading capacities (from 0.21 to 0.84 Nm2/g) in the case of the monolayer samples. The multilayered membranes exhibited increased resistance from both horizontal and vertical directions, which varies according to the specific arrangement. Finally, the cross-linked fibrous hydrogel samples not only exhibited specific loading capacities significantly higher than their counterpart bulk hydrogels but successfully withstood suturing. Although cross-linking optimisation and animal experiments are required, these membranes have great prospects as alternatives to current surgical meshes, while the methodology could also be applied in other systems as well.