Device Applications Research Articles

Comparative analysis of thermoelectric properties in bulk 2H and monolayer MoS2: a first-principles study at high temperatures

The pursuit of high-efficiency heat-to-electricity conversion is one of the indispensable driving forces toward future renewable energy production. The two-dimensional (2D) transition metal dichalcogenide, such as molybdenum disulfide (MoS2), is at the forefront of research due to its outstanding heat propagation features and potential applications as a thermoelectric material. Using the first-principles density functional theory coupled with the semi-classical Boltzmann transport equation within the constant relaxation time approximation, we present the thermoelectric and energy transport in the bulk 2H and monolayer MoS2 material system. In order to advance the underlying physics, we calculate several crucial transport parameters such as electrical conductivity, electronic thermal conductivity, Seebeck coefficient, and power factor as a function of the reduced chemical potential for different doping types and temperatures, in addition to the electron energy dispersion relation of the material system. Our comprehensive study employs the Shankland interpolation algorithm and the rigid band approximation to attain a high degree of accuracy. This thorough investigation reveals the high Seebeck coefficient of 1534 and 1550 μ V/K at 500 K for the bulk 2H and monolayer MoS2, respectively. Furthermore, the ultrahigh power factor values of 9.21 × 1011 and 3.69 × 1011 Wm −1 K −2 s −1 are shown at 800 K in the bulk 2H and monolayer MoS2, respectively. Based on the power factor results, our in-depth analysis demonstrates that the bulk 2H MoS2, when compared to monolayer MoS2, exhibits great potential as a promising semiconducting thermoelectric material for advanced high-performance energy device applications.

A 0D Ge(II)-Halide-Based Perovskite with Enhanced Semiconducting Behavior for Electronic Capacitors.

Perovskite materials have surged to the forefront of materials science, captivating researchers worldwide with their distinctive crystal lattice arrangement and remarkable optical, electric and dielectric attributes. The current study focuses on the development of a novel zero-dimensional (0D) Ge(II)-based hybrid perovskite, formulated as NH3(CH2)2NH3GeF6, and synthesized through a gradual evaporation process conducted at room temperature. The crystal structure is characterized by an arrangement of organic cations and isolated octahedral [GeF6]2- groups. This configuration is stabilized by relatively weak intermolecular bonds. A comprehensive analysis of the material's thermal properties using differential scanning calorimetry (DSC) revealed a distinct phase transition occurring at approximately 323 K, which was further confirmed through electrical measurements. The studied compound provided a broad absorption range across the visible spectrum and an optical band gap of 3.30 eV, indicating its potential for semiconducting applications in optoelectronic devices. Photoluminescence PL analysis displays a blueish broad-band emission with a high color rendering index CRI value of 91, when excited at 325 nm. This emission primarily originates from the self-trapped excitons (STEs) recombination in the inorganic [GeF6]2-. Herein, the temperature-dependent behavior of grain conductivity exhibited an Arrhenius-type pattern, with an activation energy (E a) of 0.46 eV, confirming the semiconductor nature of the investigated compound. In addition, a deep investigation of the alternating current conductivity, analyzed using Jonscher's law, demonstrates that the conduction mechanism is effectively described by the correlated barrier hopping (CBH) model. The dielectric performances show a significant dielectric constant (ε' ∼ 103). Thus, all these interesting physical properties of this hybrid perovskite have paved the way for advancements in various technological applications, particularly in the field of electronic capacitors.

Analysis of the Sr2GdTi2Nb3O15 ceramic: Investigation into its structural properties and complex impedance spectroscopy

In this study, we successfully synthesized tetragonal tungsten bronze with the nominal formula Sr2GdTi2Nb3O15 and systematically examined of its structure, dielectric, and electrical properties. The material was synthesized through the solid-state reaction technique at a temperature of 1350 °C. The formation of the tetragonal tungsten bronze in the P4/mbm space group was verified via Rietveld refinement using X-ray diffraction data. The electrical characteristics of the ceramic were examined using non-destructive complex impedance spectroscopy (CIS) across a range of frequencies (10–106 Hz) at various temperatures. The real component of impedance (Z') displayed a decrease with rising frequency, suggesting a negative temperature coefficient of resistance (NTCR) for this sample. The Cole-Cole plot of the compound exhibits two semicircles, with the compound's resistance gradually decreasing as the temperature increased. Moreover, the activation energy (Ea) was found to be approximately 0.9 eV, which confirms that oxygen vacancies are responsible for the observed relaxation behavior. Complex modulus analysis confirmed the presence of non-Debye relaxations. These results contribute to a thorough comprehension of the structural and electrical characteristics of Sr2GdTi2Nb3O15, opening avenues for potential applications in diverse electronic devices.

Super-Tough, Non-Swelling Zwitterionic Hydrogel Sensor Based on the Hofmeister Effect for Potential Motion Monitoring of Marine Animals.

Hydrogel-based electronic devices in aquatic environments have sparked widespread research interest. Nevertheless, the challenge of developing hydrogel electronics underwater has not been profoundly surmounted because of the fragility and swelling of hydrogels in aquatic environments. In this work, a zwitterionic double network hydrogel comprisedof polyvinyl alcohol (PVA), poly(sulfobetaine methacrylate) (PSBMA), and sulfuric acid (H2SO4) demonstrates super-tough and non-swelling performance. The Hofmeister effect of H2SO4 and PSBMA induces the PVA chains to form numerous nanocrystalline domains, which serve as the primary physical crosslinking points and provide effective energy dissipation. H2SO4 induces a strong salting-out effect to facilitate PVA crystallization and the formation of a dense and stable network structure that inhibits swelling. The resulting hydrogel exhibits an ultra-high toughness of 4.61MJm-3, non-swelling, and long-term stability for up to a month in pure water and seawater. Based on this, a hydrogel-based seawater strain sensor has been developed to monitor the underwater movements of marine animal models. Reliable and stable sensing performance ensures real-time collection of underwater motion signals, despite the impacts of water flow and the interference of ions. This study provides a facile approach to designing super-tough and non-swelling hydrogels and further expands the application of underwater electronic devices.

High Efficiency n-Type Doping of Organic Semiconductors by Cation Exchange.

Achieving efficient doping in n-type conjugated polymers is crucial for their application in electronic devices. In this study, an n-type doping method is developed based on cation exchange that maintains a high doping level while ensuring a high degree of structural order, leading to significantly improved electrical conductivity. By investigating various dopants and ionic liquids, it is discovered that the choice of dopant influences doping efficiency, while the selection of ionic liquid affects cation exchange efficiency. Through careful selection of suitable dopants and ionic liquids, High doping levels are achieved remarkably in a short period, resulting in the highest conductivity (nearly 1×10- 2Scm-¹) compared to other doping methods for poly{[N,N'-bis(2-octyldodecyl)-naphthalene-1,4,5,8-bis(dicarboximide)-2,6-diyl]-alt-5,5'-(2,2'-bithiophene)} (N2200). The findings highlight the robustness and efficiency of cation exchange doping as an effective approach for achieving high-quality n-type doping in conjugated polymers, thereby opening new avenues for the development of advanced polymer-based electronic devices.

Topological data analysis assisted machine learning for polar topological structures in oxide superlattices

Ferroelectric topological phases and phase transitions have been extensively investigated recently due to the rich physical insights and potential applications in next-generation electronic devices. However, precisely predicting the topological phase transitions under different internal and external conditions in polar oxide superlattice systems is challenging due to the complex energy competitions and highly nonlinear kinetics involved. Herein, we adopted a state-of-the-art mathematical concept called “persistent homology” from topological data analysis to extract the essential topological features for the polarization data in various topological structures. By implementing the persistent image as the descriptor, support vector regression (SVR) based convolutional neural network (CNN) models are developed for the automated and high precision classification and regression of topological states based on high-dimensional phase-field simulation data of the PTO/STO superlattice. Using this method, we can automatically construct the strain and electric field phase diagrams in seconds with high throughput phase-field data. We hope to spur further interest in the integration of state-of-the-art mathematical tools, machine learning algorithms, and condensed matter physics for predictions of topological phase transitions.

Impact of Laser Ablation Strategies on Electrochemical Performances of 3D Batteries Containing Aqueous Acid Processed Li(Ni0.6Mn0.2Co0.2)O2 Cathodes with High Mass Loading

Lithium-ion batteries are currently one of the most important energy storage devices for various applications. However, it remains a great challenge to achieve both high energy density and high-power density while reducing the production costs. Cells with three-dimensional electrodes realized by laser ablation are proven to have enhanced electrochemical performance compared to those with conventional two-dimensional electrodes, especially at fast charging/discharging. Nevertheless, laser structuring of electrodes is still limited in terms of achievable processing speed, and the upscaling of the laser structuring process is of great importance to gain a high technology readiness level. In the presented research, the impact of different laser structuring strategies on the electro-chemical performance was investigated on aqueous processed Li(Ni0.6Mn0.2Co0.2)O2 cathodes with acid addition during the slurry mixing process. Rate capability analyses of cells with laser structured aqueous processed electrodes exhibited enhanced performance with capacity increases of up to 60 mAh/g at high current density, while a 65% decrease in ionic resistance was observed for cells with laser structured electrodes. In addition, pouch cells with laser structured acid-added electrodes maintained 29–38% higher cell capacity after 500 cycles and their end-of-life was extended by a factor of about 4 in contrast to the reference cells with two-dimensional electrodes containing common organic solvent processed polyvinylidene fluoride binder.

Polarization Independent Dynamic Beam Steering based on Liquid Crystal Integrated Metasurface

Digital Micromirror Devices, extensively employed in projection displays offer rapid, polarization-independent beam steering. However, they are constrained by microelectromechanical system limitations, resulting in reduced resolution, limited beam steering angle and poor stability, which hinder further performance optimization. Liquid Crystal on Silicon technology, employing liquid crystal (LC) and silicon chip technology, with properties of high resolution, high contrast and good stability. Nevertheless, its polarization-dependent issues lead to complex system and low efficiency in device applications. This paper introduces a hybrid integration of metallic metasurface with nematic LC, facilitating a polarization-independent beam steering device capable of large-angle deflections. Employing principles of geometrical phase and plasmonic resonances, the metallic metasurface, coupled with an electronically controlled LC, allows for dynamic adjustment, achieving a maximum deflection of ± 27.1°. Additionally, the integration of an LC-infused dielectric grating for dynamic phase modulation and the metasurface for polarization conversion ensures uniform modulation effects across all polarizations within the device. We verify the device’s large-angle beam deflection capability and polarization insensitivity effect in simulations and propose an optimization scheme to cope with the low efficiency of individual diffraction stages.

Resonant tunneling properties of laser dressed hyperbolic Pöschl-Teller double barrier potential

We examine the resonant tunneling properties of the laser-dressed hyperbolic Pöschl-Teller double quantum barrier structure. We use the non-equilibrium Green's function method to investigate structure parameters and electric field bias on the transmission properties of the system. The transmission probabilities and resonance energy levels are significantly influenced by the well widths and barrier heights. The barrier height increases, resonance energy levels shift toward higher values, and the resonance peak width narrows, leading to sharper and more selective tunneling behavior. Our results show that increasing the electric field bias leads to a decrease in the transmission probability at the first resonance peak, but this effect is not as strong for the subsequent peaks. Moreover, we find that changes in the laser field's parameter and structure parameters allow for fine control over the electronic spectra, allowing for modifications like red or blue shifts based on particular needs. The significance of comprehending the interaction among structural factors, external fields, and transmission qualities in quantum barrier structures is highlighted by our research, providing valuable information for the development and enhancement of electronic and optoelectronic systems with customized functionality. Our findings show the laser field has a considerable impact on resonant tunneling properties, opening the door to new device applications.

Ceramics for Microelectromechanical Systems Applications: A Review

A comprehensive review of the application of different ceramics for MEMS devices is presented. Main ceramics materials used for MEMS systems and devices including alumina, zirconia, aluminum Nitride, Silicon Nitride, and LTCC are introduced. Conventional and new methods of fabricating each material are explained based on the literature, along with the advantages of the new approaches, mainly additive manufacturing, i.e., 3D-printing technologies. Various manufacturing processes with relevant sub-techniques are detailed and the ones that are more suitable to have an application for MEMS devices are highlighted with their properties. In the main body of this paper, each material with its application for MEMS is categorized and explained. The majority of works are within three main classifications, including the following: (i) using ceramics as a substrate for MEMS devices to be mounted or fabricated on top of it; (ii) ceramics are a part of the materials used for an MEMS device or a monolithic fabrication of MEMS and ceramics; and finally, (iii) using ceramics as packaging solution for MEMS devices. We elaborate on how ceramics may be superior substitutes over other materials when delicate MEMS-based systems need to be assembled or packaged by a simpler fabrication process as well as their advantages when they need to operate in harsh environments.

Laser-driven synthesis of functional materials for advanced energy applications: A short review

Since the initial exploration of synthesis possibilities at a liquid–solid interface through pulsed laser irradiation of iron in water, the pulsed laser ablation in liquid media (PLAL) process has garnered significant attention for constructing various nanostructures due to its simple, ultrafast, and clean methodology that avoids byproduct formation. Recent advances in functionalized heterostructures via the PLAL process suggest a broad range of applications for energy- conversion systems, including water splitting and energy harvesting. This review surveys recent advancements in PLAL for energy applications, with a specific focus on its applications in oxygen evolution reaction (OER) electrocatalysts and energy harvesting devices. The review discusses the synthesis mechanisms, advantages, challenges, and future research directions of PLAL, aiming to provide a comprehensive understanding of its potential and limitations.

Theoretical calculations of nonlinear optical responses for interpreting nonconjugated molecular systems to affect non-optimal properties

Understanding the intricacies of polymorphic origins in nonconjugated crystal systems is crucial for optimizing their properties. This study focuses on the crystal growth, characterization, and nonlinear optical (NLO) responses of a system analyzed using single crystal X-ray analysis, revealing a monoclinic geometry. Hirschfeld surface analysis emphasized the significance of intermolecular interactions in driving polymorph development, shedding light on the structural nuances influencing the material’s properties. Through the evaluation of density functional theory parameters, the research found that the NLO responses of the system were as efficient as those of widely recognized materials like urea and KDP. Moreover, the stability of the system was confirmed through (NBO) analysis, showcasing its potential for practical applications. By manipulating the polymorphic crystal forms, researchers can potentially unveil new crystalline materials with tailored properties suitable for applications in optical and optoelectronic devices. This work underscores the importance of exploring novel crystal engineering strategies to harness the full potential of materials in the realm of advanced technologies.

Review of Liquid Metal Fiber Based Biosensors and Bioelectronics.

Liquid metal, as a novel material, has become ideal for the fabrication of flexible conductive fibers and has shown great potential in the field of biomedical sensing. This paper presents a comprehensive review of the unique properties of liquid metals such as gallium-based alloys, including their excellent electrical conductivity, mobility, and biocompatibility. These properties make liquid metals ideal for the fabrication of flexible and malleable biosensors. The article explores common preparation methods for liquid metal conductive fibers, such as internal liquid metal filling, surface printing with liquid metal, and liquid metal coating techniques, and their applications in health monitoring, neural interfaces, and wearable devices. By summarizing and analyzing the current research, this paper aims to reveal the current status and challenges of liquid metal conductive fibers in the field of biosensors and to look forward to their development in the future, which will provide valuable references and insights for researchers in the field of biomedical engineering.

Toward more practical site density determination in Fe-N-C catalysts for oxygen reduction reaction: NO-stripping at gas diffusion electrode setup

Evaluation of the site density of single-site iron catalysts has always been a challenge due to the complexity of those materials, and the difficulty of finding selective and simple probing methodologies. Since iron coordinating nitrogen (FeN4) is recognized as the main active site for oxygen reduction reaction (ORR), it is fundamental to develop a method to assess the content in catalysts. Several bulk-probing and surface-probing methods have been developed in the last decade each one with its pros and cons. Among others, with certain limitations, NO stripping performed at a rotating disc electrode (RDE) has become a common characterization to evaluate site density and turnover frequency of Fe-N-C due to the relatively simple procedure. At the same time, gaining information on the activity on more practical devices has brought to the spreading of gas diffusion electrodes (GDE) in half-cell configuration to mimic the cathodic compartment of a fuel cell, a leading device for those materials applications. Here we proposed a transposition of NO-stripping from RDE to GDE to evaluate the site density under more practical devices. Several parameters have been considered (i.e., pH, loading, FeN4 selectiveness) and comparisons with RDE have been done to validate the methods. A homemade Fe-N-C catalyst has been used as a benchmark and compared to Pajarito Powder catalyst and others (including metal-free) showing the validity and selectivity of the method.

Retraction Note: An efficient deep learning based stress monitoring model through wearable devices for health care applications

Retraction Note: An efficient deep learning based stress monitoring model through wearable devices for health care applications

3D Printing of Hierarchical Structures Made of Inorganic Silicon-Rich Glass Featuring Self-Forming Nanogratings.

Hierarchical structures are abundant in nature, such as in the superhydrophobic surfaces of lotus leaves and the structural coloration of butterfly wings. They consist of ordered features across multiple size scales, and their advantageous properties have attracted enormous interest in wide-ranging fields including energy storage, nanofluidics, and nanophotonics. Femtosecond lasers, which are capable of inducing various material modifications, have shown promise for manufacturing tailored hierarchical structures. However, existing methods, such as multiphoton lithography and three-dimensional (3D) printing using nanoparticle-filled inks, typically involve polymers and suffer from high process complexity. Here, we demonstrate the 3D printing of hierarchical structures in inorganic silicon-rich glass featuring self-forming nanogratings. This approach takes advantage of our finding that femtosecond laser pulses can induce simultaneous multiphoton cross-linking and self-formation of nanogratings in hydrogen silsesquioxane. The 3D printing process combines the 3D patterning capability of multiphoton lithography and the efficient generation of periodic structures by the self-formation of nanogratings. We 3D-printed micro-supercapacitors with large surface areas and a high areal capacitance of 1 mF/cm2 at an ultrahigh scan rate of 50 V/s, thereby demonstrating the utility of our 3D printing approach for device applications in emerging fields such as energy storage.

Tuning Electrostatics to Promote Ordered Monolayers of Phosphole-Lipids.

Heteroatom-doped π-conjugated systems have been exploited for electronic device applications. Phosphole-containing backbones are particularly intriguing with regard to electron delocalization and ultimately control over the photophysical, redox, and charge transfer characteristics. However, practical application of these materials commonly relies on well-structured, thin film architectures. Self-assembly offers a route to generate ordered 2D structures deposited on solid substrates. The orientation of these deposited films can be manipulated by the introduction of alkyl chains of varying length (to form phosphole-based lipids) and chemical modification of the phosphole-derived headgroup. External controls can also be considered to tune these films' properties, e.g., the electrostatic interactions within the film can be controlled by varying the environment with the addition of simple salt counterions. A series of lipids with phosphole-based π-conjugated headgroups have been designed and exhibit intramolecular conformational changes in response to external conditions. Herein the 2D film structure in Langmuir and Langmuir-Blodgett films is reported in the presence and absence of halide salts. The film morphology obtained from Brewster angle and atomic force microscopy shows the formation of a condensed phase but also 3D aggregates, and grazing incidence X-ray diffraction confirmed the presence of untilted, hexagonally packed chains. The size of the counterion influences its ability to intercalate between the phosphole headgroups, which ultimately provides a means to induce the formation of a well-ordered, single monolayer film without aggregates that can be transferred to the solid substrate.

Modification of microstructure, optical, and electrical properties in 180 keV Co and Fe implanted Al1.5Ga0.5O3 thin-films

We report the microstructure, optical and electrical properties of Al1.5Ga0.5O3 thin films implanted by 180 keV Fe and Co ions. The X-ray diffraction pattern confirmed rhombohedral structure with R 3‾ c space group for pristine and Fe-implanted films. The Co-implanted films showed amorphous structure. SRIM simulations suggested oxygen vacancy in the films. The atomic force microscopy confirmed the formation of spherical-shaped particles (17–20 nm) in Co-implanted GaAlO_Si_550 films. The RMS roughness of the GaAlO_Si_550 films increased from 19 nm to 25 nm at higher Co-ion implantation fluences. X-ray photoelectron spectroscopy supported the formation of oxygen vacancy and non-stoichiometry at surface of the films. Electrical conductivity of the films enhanced up to 10−2- 10−3 S/m by metallic Fe- and Co ion implantation. Optical band gap was found at ∼3.85 eV for GaAlO_Al_550 and ∼4.04 eV for GaAlO_Si_550 pristine films. Optical band gap was stabilized in the range of 3.75–4.52 eV for Fe- and Co-implanted films, which can be useful for opto-electronic device applications in the UV and deep blue region.

Prediction of multiferroicity in the layered hydrogen-bonded system α-CrOOH: Proton transfer ferroelectricity and strain-tunable magnetic transition

Ferroelectric materials with vertical polarization could provide ground-breaking device applications, compatible with electric-field switching even in the presence of a surface-depolarizing field. Herein, we present theoretical evidence that rhombohedral chromium oxide hydroxide α-CrOOH, which has been synthesized experimentally, is a type-Ⅰ multiferroic. First-principles calculations plus Monte Carlo simulations indicate that α-CrOOH is a room temperature proton transfer ferroelectricity semiconductor with robust electric polarization as large as 24.6 μC/cm2. Moreover, the system exhibits an anti-ferromagnetism ground state with a Neel temperature of 340 K, where strain can modulate the transition from antiferromagnetic to ferromagnetic. Finally, a two-dimensional (2D) heterostructure model was designed, composed of monolayer α-CrOOH and functional MXene, for various applications such as non-volatile memory (NVM). The remarkable properties may enable the system to hold great potential for the development of future multifunctional devices.

Nanocrystalization effects on the structural, electrical and thermoelectric properties of 10KNbO3-10Fe2O3-50B2O3-30V2O5 glass for non-volatile electronic-memory devices

AbstractThe composition: 10KNbO3-10Fe2O3-50B2O3-30V2O5 (in mol%) is produced using the conventional melt quenching method and their corresponding glass–ceramic nanocomposites were studied. The structural properties of the as-quenched sample and its heat-treated samples were investigated using X-ray diffraction and differential thermal analysis. Density (ρ) was found to decrease with increasing average nanocrystallite size as the molar volume increases. Studies on thermoelectric power have been carried out. The glass–ceramic nanocomposite after 2 h of heating exhibits significant improvement of electrical conductivity. The activation energy (W), polaron radius (rp) and other parameters have been estimated in the non-adiabatic region. The current–voltage (I–V) curve of each sample was measured. A temporal analysis of current & voltage in nonlinear I–V curves show pinched hysteresis loop, which is the memristor’s fingerprint. The glass–ceramic nanocomposite after 2 h of heating exhibits a large switching window. The results of the study enable us to predict that they will be helpful for future applications of non-volatile electronic-memory devices.