Material System Research Articles

Design of Soft/Hard Interface with High Adhesion Energy and Low Interfacial Thermal Resistance via Regulation of Interfacial Hydrogen Bonding Interaction.

Adhesion ability and interfacial thermal transfer capacity at soft/hard interfaces are of critical importance to a wide variety of applications, ranging from electronic packaging and soft electronics to batteries. However, these two properties are difficult to obtain simultaneously due to their conflicting nature at soft/hard interfaces. Herein, we report a polyurethane/silicon interface with both high adhesion energy (13535 J m-2) and low thermal interfacial resistance (0.89 × 10-6 m2 K W-1) by regulating hydrogen interactions at the interface. This is achieved by introducing a soybean-oil-based epoxy cross-linker, which can destroy the hydrogen bonds in polyurethane networks and meanwhile can promote the formation of hydrogen bonds at the polyurethane/silicon interface. This study provides a comprehensive understanding of enhancing adhesion energy and reducing interfacial thermal resistance at soft/hard interfaces, which offers a promising perspective to tailor interfacial properties in various material systems.

Additive manufacturing with varying material properties of thermosetting reactive polymers: a framework and comparison of different modes for implementing material transitions

Additive Manufacturing with Varying Material Properties enables controlled spatial variation of material properties in 3D-printed components, facilitating custom-tailored characteristics, added functionalities and reduced assembly processes. To promote this approach in building façade applications, this paper presents a novel framework for Additive Manufacturing with varying material properties using a thermosetting reactive polymer, specifically polyurethane. By dynamically changing the polyurethane’s chemical composition, the material properties can be precisely controlled. The framework’s individual aspects, including the material, hardware setup and computational system, are described in detail. Additionally, the research explores the implementation of material transitions with this framework, highlighting three different modes (horizontal, vertical and multi plane) and their impact on print time and material consumption. The paper concludes by discussing the potential of this approach for building façade applications, addressing current challenges and outlining future research directions.

Flyways Beyond Migratory Pathways: The Case of Waterbird Conservation

Abstract For almost a century, the term ‘flyways’ has been used to order relations over time and space. It has been used to coordinate scientific research and communication as well as monitoring and management efforts for waterbird conservation. In this article, we revisit the concept of ‘boundary object’ (Star and Griesemer 1989) to investigate how this term ‘flyways’ has been central to common efforts while also having multiple meanings for the actors it connects. The article discusses both contemporary and historical achievements of the term by analysing its underlying knowledge infrastructure. We account for the complex assemblages of social, material, natural, and technical systems that shape how the term ‘flyway’ has been functioning as a boundary object and how this has changed over time. By discussing how the term ‘flyways’ as a boundary object and its underlying knowledge infrastructure shape each other, we empower the actors to define, visualise, communicate, and imagine flyways in more purposeful ways. Our analysis contributes to the literature on boundary objects and knowledge infrastructures by expanding their original definitions, arguing for a co-productive relation between them.

Nanomechanical and Microstructural Characterization of Biocompatible Ti3Au Thin Films Grown on Glass and Ti6Al4V Substrates.

Ti-Au intermetallic-based material systems are being extensively studied as next-generation thin film coatings to extend the lifetime of implant devices. These coatings are being developed for application to the articulating surfaces of total joint implants and, therefore, must have excellent biocompatibility combined with superior mechanical hardness and wear resistance. However, these key characteristics of Ti-Au coatings are heavily dependent upon factors such as the surface properties and temperature of the underlying substrate during thin film deposition. In this work, Ti3Au thin films were deposited by magnetron sputtering on both glass and Ti6Al4V substrates at an ambient and elevated substrate temperature of 275 °C. These films were studied for their mechanical properties by the nanoindentation technique in both variable load and fixed load mode using a Berkovich tip. XRD patterns and cross-sectional SEM images detail the microstructure, while AFM images present the surface morphologies of these Ti3Au thin films. The biocompatibility potential of the films is assessed by cytotoxicity tests in L929 mouse fibroblast cells using Alamar blue assay, while leached ion concentrations in the film extracts are quantified using ICPOEMS. The standard deviation for hardness of films deposited on glass substrates is ∼4 times lower than that on Ti6Al4V substrates and is correlated with a corresponding increase in surface roughness from 2 nm for glass to 40 nm for Ti6Al4V substrates. Elevating substrate temperature leads to an increase in film hardness from 5.1 to 8.9 GPa and is related to the development of a superhard β phase of the Ti3Au intermetallic. The standard deviation of this peak mechanical hardness value is reduced by ∼3 times when measured in fixed load mode compared to the variable load mode due to the effect of nanoindentation tip penetration depth. All tested Ti-Au thin films also exhibit excellent biocompatibility against L929 fibroblast cells, as viability levels are above 95% and leached Ti, Al, V, and Au ion concentrations are below 0.1 ppm. Overall, this work demonstrates a novel Ti3Au thin film system with a unique combination of high hardness and excellent biocompatibility with potential to be developed into a new wear-resistant coating to extend the lifetime of articulating total joint implants.

Responsive materials nanoarchitectonics at interfaces

AbstractAdvanced materials could perform functions in response to external stimuli. These are responsive materials. In order for us to develop advanced functional systems with a good responsive nature, we need to create a methodology that goes one step further. It is the artificial architecture of functional material systems based on the knowledge of nanotechnology. The task will be fulfilled by the new concept of nanoarchitectonics. Nanoarchitectonics integrates nanotechnology with various material sciences, basic chemistry, microfabrication techniques, and biological processes to architect functional material systems from atomic, molecular, and nanomaterial units. This review will deal with the nanoarchitectonics of responsive materials related with phenomena at interfaces. In order to demonstrate the effectiveness of responsive materials nanoarchitectonics at interfaces for functional systems of various sizes, this review article is organized by size for various functional systems. Specifically, this review has grouped them into (i) molecular level response, (ii) nanodevice level response, (iii) material level response, and (iv) living cell level response. If the social demand for these materials is fully recognized, such development is expected to efficiently progress. This review article would play a role in stimulating such development.

Large impact of phonon lineshapes on the superconductivity of solid hydrogen

Phonon anharmonicity plays a crucial role in determining the stability and vibrational properties of high-pressure hydrides. Furthermore, strong anharmonicity can render phonon quasiparticle picture obsolete questioning standard approaches for modeling superconductivity in these material systems. In this work, we show the effects of non-Lorentzian phonon lineshapes on the superconductivity of high-pressure solid hydrogen. We calculate the superconducting critical temperature TC ab initio considering the full phonon spectral function and show that it overall enhances the TC estimate. The anharmonicity-induced phonon softening exhibited in spectral functions increases the estimate of the critical temperature, while the broadening of phonon lines due to phonon-phonon interaction decreases it. Our calculations also reveal that superconductivity emerges in hydrogen in the Cmca − 12 molecular phase VI at pressures between 450 and 500 GPa and explain the disagreement between the previous theoretical results and experiments.

Magneto-transport in the monolayer MoS2 material system for high-performance field-effect transistor applications

Electronic transport in monolayer MoS2 is significantly constrained by several extrinsic factors despite showing good prospects as a transistor channel material. Our paper aims to unveil the underlying mechanisms of the electrical and magneto-transport in monolayer MoS2. In order to quantitatively interpret the magneto-transport behavior of monolayer MoS2 on different substrate materials, identify the underlying bottlenecks, and provide guidelines for subsequent improvements, we present a deep analysis of the magneto-transport properties in the diffusive limit. Our calculations are performed on suspended monolayer MoS2 and MoS2 on different substrate materials taking into account remote impurity and the intrinsic and extrinsic phonon scattering mechanisms. We calculate the crucial transport parameters such as the Hall mobility, the conductivity tensor elements, the Hall factor, and the magnetoresistance over a wide range of temperatures, carrier concentrations, and magnetic fields. The Hall factor being a key quantity for calculating the carrier concentration and drift mobility, we show that for suspended monolayer MoS2 at room temperature, the Hall factor value is around 1.43 for magnetic fields ranging from 0.001 to 1 Tesla, which deviates significantly from the usual value of unity. In contrast, the Hall factor for various substrates approaches the ideal value of unity and remains stable in response to the magnetic field and temperature. We also show that the MoS2 over an Al2O3 substrate is a good choice for the Hall effect detector. Moreover, the magnetoresistance increases with an increase in magnetic field strength for smaller magnetic fields before reaching saturation at higher magnetic fields. The presented theoretical model quantitatively captures the scaling of mobility and various magnetoresistance coefficients with temperature, carrier densities, and magnetic fields.

Zn-Doped MnO2 microflake pseudocapacitive cathode on Ni(OH)2/Ni-Foam substrate as a promising charge storage material

Zn-doped MnO2 microflakes cathode material on Ni(OH)2/Ni foam has been synthesized and characterized as well as tested its electrochemical performances in 3 M KOH solution. The present work varies the amounts of Zn dopant in MnO2 system to improve its capability in energy storage. Material identification has been simply confirmed with XRD, SEM, TEM, and XPS analysis. It is expected the Zn dopant will induce surface defects such as ZnMn2- or ZnMn0 and oxygen vacancy, leading to enhanced charge storage efficiency. In addition, XPS analysis reveals the existence of positively charged oxygen vacancy and the surface charge of ZnMn2- or ZnMn0 induce different surface oxidation states of Mn2+ and Mn4+. The oxidation states of Mn could accommodate the redox reactions involving ion adsorption and intercalation during pseudocapacitive charge and discharge processes. Substituting Zn into Mn sites is optimized with MnZn-1.5 which reaches a specific capacitance of 1601F/g at a 0.4 VAg/AgCl in KOH solution. This work demonstrates a promising material system for supercapacitor applications using Zn doping with a simple preparation process to support a large-scale application.

Enhancing Mechanical Properties and Microstructures of Mass-Manufactured Sand Concrete by Incorporating Granite Powder

The production of manufactured sand and stone processing can cause dust pollution due to the generation of a significant amount of stone powder. This dust (mainly granite powder) was collected and incorporated as a cement replacement into mass-manufactured sand concrete in order to enhance the mechanical properties and microstructures. The heat of the hydration was measured by adding the granite powder into the cementitious material system. The mechanical properties, autogenous shrinkage, and pore structures of the concrete were tested. The results showed that the mechanical strength of the concrete increased first and then decreased with the increase in granite powder content. By replacing the 5% cement with the granite powder, the 28 d compressive and flexural strength increased by 17.6% and 20.9%, respectively. The autogenous shrinkage was mitigated by the incorporation of the 10% granite powder and decreased by 19.7%. The mechanism of the granite powder in the concrete was studied by X-ray diffraction (XRD), scanning electron microscopy (SEM), and mercury intrusion porosimetry (MIP). The porosity decreased significantly within the 10% granite powder. A microstructure analysis did not reveal a change in the type of hydration products but rather that the granite powder played a role in the microcrystalline nucleation during the hydration process.

Perspective: Probing elasto-quantum materials with X-ray techniques and in situ anisotropic strain.

Anisotropic lattice deformation plays an important role in the quantum mechanics of solid state physics. The possibility of mediating the competition and cooperation among different order parameters by applying in situ strain/stress on quantum materials has led to discoveries of a variety of elasto-quantum effects on emergent phenomena. It has become increasingly critical to have the capability of combining the in situ strain tuning with X-ray techniques, especially those based on synchrotrons, to probe the microscopic elasto-responses of the lattice, spin, charge, and orbital degrees of freedom. Herein, we briefly review the recent studies that embarked on utilizing elasto-X-ray characterizations on representative material systems and demonstrated the emerging opportunities enabled by this method. With that, we further discuss the promising prospect in this rising area of quantum materials research and the bright future of elasto-X-ray techniques.&#xD.

A study on the thermomechanical response of various die attach metallic materials of power electronics

PurposeIn power electronics, there are various metallic material systems used as die attachments. The complete understanding of the thermomechanical behavior of such interconnections is very important. Therefore, this paper aims to examine the thermomechanical response of four famous die attach materials, including sintered silver, sintered nano-copper particles, gold-tin solders and silver-tin transient liquid phase (TLP) bonds, using nonlinear finite element analysis.Design/methodology/approachDuring the study, the mechanical properties of all die attach systems, including elastic and viscoplasticity parameters, are obtained from literature studies and hence incorporated into the numerical analysis. Subsequently, the bond stress–strain relationships, stored inelastic strain energies and equivalent plastic strains are thoroughly examined.FindingsThe results showed that the silver-tin TLP bonds are more likely to develop higher inelastic strain energy densities, while the sintered silver and copper interconnects would possess higher plastic strains and deformations. Suggesting higher damage to such metallic die attachments. The expensive gold-based solders have developed least inelastic strain energy densities and least plastic strains as well. Thus, they are expected to have improved fatigue performance compared to other bonding configurations.Originality/valueThis paper extensively investigates and compares the mechanical and thermal response of various metallic die attachments. In fact, there are no available research studies that discuss the behavior of such important die attachments of power electronics when exposed to mechanical and thermomechanical loads.

Theoretical substantiation of system for organising preventive treatment of asphalt concrete road pavements

Introduction. Over the past 20 years, the fleet of vehicles in the Republic of Belarus has increased significantly, and, consequently, the intensity of traffic on roads with a proportional increase in wear and tear of their surfaces. The need to protect asphalt concrete pavements from premature destruction dictates the search for new technological solutions. To effectively protect asphalt concrete pavements from the complex effects of water and traffic loads in the autumn-winter and spring-winter periods, the author has developed and implemented one of the options for protecting asphalt concrete pavements of a highway – treating them with a hydrophobic preventive Protekt- 01composition.Materials and methods. The research used theoretical and practical results from the implementation of the developed hydrophobic prophylactic composition.Results. The article presents an overview of the state of the problem of preventing destruction of asphalt concrete pavements abroad and in the Republic of Belarus, an analysis of the measures taken to implement the developed hydrophobic preventive Protekt-01composition at transport infrastructure facilities, and also, based on the data obtained from production testing a ‘System for organizing preventive treatment’ has been proposed, which will be aimed at preventing the beginning and future destruction of the asphalt concrete pavement of highways and will be based on monitoring the technical condition of the control object, planning, organizing, implementing and managing preventive and repair measures using navigation equipment and software that makes it possible to optimize the balance of costs and road surface defects.Originality. Thus, based on the theoretical substantiation and the results of practical implementation of the developed composition, the following are proposed:- method for ensuring the operation of a control system for liquid road-building materials which enables to eliminate overconsumption of the distributed substance;- ‘System for organizing preventive treatment’, which enables to increase the service life of asphalt concrete pavement by 1.2–1.5 times.

Low-Temperature Deposited Amorphous Poly(aryl ether ketone) Hierarchically Porous Scaffolds with Strontium-Doped Mineralized Coating for Bone Defect Repair.

In recent years, the demand for clinical bone grafting has increased. As a new solution for orthopedic implants, polyether ether ketone (PEEK, crystalline PAEK) has excellent comprehensive performance and has been practically applied in clinic. In this research, a noteworthy elevated scheme to enhance the performance of PEEK scaffolds was presented. The amorphous aggregated poly (aryl ether ketone) (PAEK) resin was prepared as the matrix material, which maintained high mechanical strength and could be processed through solution. So, the tissue engineering scaffolds with multilevel pores could be printed by low-temperature deposited manufacturing (LDM) to improve biologically inert scaffolds with smooth surfaces. Also, the feature of PAEK's solution processing is profitable to uniformly add the functional components for bone repair. Ultimately, A system of orthopedic implantable PAEK material based on intermolecular interactions, surface topology, and surface modification was established. The specific steps include synthesizing PAEK that contain polar carboxyl structures, preparing bioinks and fabricating scaffolds by LDM, preparation of scaffolds with strontium-doped mineralized coatings, evaluation of their osteogenic properties in vitro and in vivo, and investigation on the effect and mechanism of scaffolds in promoting osteogenic differentiation. This work provides an upgraded system of PAEK implantable materials for clinical application. This article is protected by copyright. All rights reserved.

Superdurable Full-Life Superhydrophobic Composite Block.

Superhydrophobic materials are attractive for industrial development but plagued by poor mechanical stability. Herein, we have designed and fabricated a superdurable full-life superhydrophobic composite block by embedding near-zero contractive superhydrophobic silica aerogel into a rigid iron-nickel foam structured similarly to a regular dodecahedron. The synergistic protection afforded by these materials ensures superrobust mechanical stability for our composite block, which features a high compressive strength of up to ∼7.4MPa, and ultralow Taber abrasion of down to ∼0.567mm after withstanding 50,000 cycles, and highly efficient water harvesting capability of up to ∼3,114.3mg min-1 cm-2 at a supercooling degree of 40 K. This robust material system provides a novel strategy to design superhydrophobic materials capable of withstanding extreme conditions, including high temperature, humidity, pressure, and abrasion. This article is protected by copyright. All rights reserved.

Exciton Localization Modulated by Ultradeep Moiré Potential in Twisted Bilayer γ-Graphdiyne.

Twisted moiré superlattice is featured with its moiré potential energy, the depth of which renders an effective approach to strengthening the exciton-exciton interaction and exciton localization toward high-performance quantum photonic devices. However, it remains as a long-standing challenge to further push the limit of moiré potential depth. Herein, owing to the pz orbital induced band edge states enabled by the unique sp-C in bilayer γ-graphdiyne (GDY), an ultradeep moiré potential of ∼289 meV is yielded. After being twisted into the hole-to-hole layer stacking configuration, the interlayer coupling is substantially intensified to augment the lattice potential of bilayer GDY up to 475%. The presence of lateral constrained moiré potential shifts the spatial distribution of electrons and holes in excitons from the regular alternating mode to their respective separated and localized mode. According to the well-established wave function distribution of electrons contained in excitons, the AA-stacked site is identified to serve for exciton localization. This work extends the materials systems available for moiré superlattice design further to serial carbon allotropes featured with benzene ring-alkyne chain coupling, unlocking tremendous potential for twistronic-based quantum device applications.

Towards accurate prediction of configurational disorder properties in materials using graph neural networks

The prediction of configurational disorder properties, such as configurational entropy and order-disorder phase transition temperature, of compound materials relies on efficient and accurate evaluations of configurational energies. Previous cluster expansion methods are not applicable to configurationally-complex material systems, including those with atomic distortions and long-range orders. In this work, we propose to leverage the versatile expressive capabilities of graph neural networks (GNNs) for efficient evaluations of configurational energies and present a workflow combining attention-based GNNs and Monte Carlo simulations to calculate the disorder properties. Using the dataset of face-centered tetragonal gold copper without and with local atomic distortions as an example, we demonstrate that the proposed data-driven framework enables the prediction of phase transition temperatures close to experimental values. We also elucidate that the variance of the energy deviations among configurations controls the prediction accuracy of disorder properties and can be used as the target loss function when training and selecting the GNN models. The work serves as a fundamental step toward a data-driven paradigm for the accelerated design of configurationally-complex functional material systems.

ON-OFF Control of Marangoni Self-propulsion via A Supra-amphiphile Fuel and Switch.

Marangoni self-propulsion refers to motions of liquid or solids driven by a surface tension gradient, and has applications in soft robots/devices, cargo delivery, self-assembly etc. However, two problems remain to be addressed for motion control (e.g., ON-OFF) with conventional surfactants as Marangoni fuel: (1) limited motion lifetime due to saturated interfacial adsorption of surfactants; (2) in- situ motion stop is difficult once Marangoni flows are triggered. Instead of covalent surfactants, supra-amphiphiles with hydrophilic and hydrophobic parts linked noncovalently, hold promise to solve these problems owing to its dynamic and reversible surface activity responsively. Here, we propose a new concept of 'supra-amphiphile fuel and switch' based on the facile synthesis of disodium-4-azobenzene-amino-1,3-benzenedisulfonate (DABS) linked by a Schiff base, which has amphiphilicity for self-propulsion, hydrolyzes timely to avoid saturated adsorption and provides pH-responsive control over ON-OFF motion. The self-propulsion lifetime is extended by 50-fold with DABS and motion control is achieved. The mechanism is revealed with coupled interface chemistry involving two competitive processes of interfacial adsorption and hydrolysis of DABS based on both experiments and simulation. The concept of 'supra-amphiphile fuel and switch' provides an active solution to prolong and control Marangoni self-propulsive devices for the advance of intelligent material systems.

ON‐OFF Control of Marangoni Self‐propulsion via A Supra‐amphiphile Fuel and Switch

Marangoni self‐propulsion refers to motions of liquid or solids driven by a surface tension gradient, and has applications in soft robots/devices, cargo delivery, self‐assembly etc. However, two problems remain to be addressed for motion control (e.g., ON‐OFF) with conventional surfactants as Marangoni fuel: (1) limited motion lifetime due to saturated interfacial adsorption of surfactants; (2) in‐ situ motion stop is difficult once Marangoni flows are triggered. Instead of covalent surfactants, supra‐amphiphiles with hydrophilic and hydrophobic parts linked noncovalently, hold promise to solve these problems owing to its dynamic and reversible surface activity responsively. Here, we propose a new concept of ‘supra‐amphiphile fuel and switch’ based on the facile synthesis of disodium‐4‐azobenzene‐amino‐1,3‐benzenedisulfonate (DABS) linked by a Schiff base, which has amphiphilicity for self‐propulsion, hydrolyzes timely to avoid saturated adsorption and provides pH‐responsive control over ON‐OFF motion. The self‐propulsion lifetime is extended by 50‐fold with DABS and motion control is achieved. The mechanism is revealed with coupled interface chemistry involving two competitive processes of interfacial adsorption and hydrolysis of DABS based on both experiments and simulation. The concept of ‘supra‐amphiphile fuel and switch’ provides an active solution to prolong and control Marangoni self‐propulsive devices for the advance of intelligent material systems.

Research on the creep response of lead-free die attachments in power electronics

PurposeThe purpose of this paper is to investigate the thermomechanical response of four well-known lead-free die attach materials: sintered silver, sintered nano-copper particles, gold-tin solders and silver-tin transient liquid phase (TLP) bonds.Design/methodology/approachThis examination is conducted through finite element analysis. The mechanical properties of all die attach systems, including elastic and Anand creep parameters, are obtained from relevant literature and incorporated into the numerical analysis. Consequently, the bond stress-strain relationships, stored inelastic strain energies and equivalent plastic strains are thoroughly examined.FindingsThe results indicate that silver-tin TLP bonds are prone to exhibiting higher inelastic strain energy densities, while sintered silver and copper interconnects tend to possess higher levels of plastic strains and deformations. This suggests a higher susceptibility to damage in these metallic die attachments. On the other hand, the more expensive gold-based solders exhibit lower inelastic strain energy densities and plastic strains, implying an improved fatigue performance compared to other bonding configurations.Originality/valueThe utilization of different metallic material systems as die attachments in power electronics necessitates a comprehensive understanding of their thermomechanical behavior. Therefore, the results of the present paper can be useful in the die attach material selection in power electronics.

Prediction of the penetration depth of particle-loaded inks in binder jetting

AbstractParticle-loaded inks in binder jetting have proven to increase the packing density of the powder bed, to improve the sintering properties, and to selectively change the material composition in the part. However, particles also change the rheological properties and thus the penetration behavior of the ink in the powder bed. The penetration behavior influences the reliability of the binder jetting process. To ensure adequate accuracy and sufficient strength of the green part, an effective connection between the layers is crucial. Insufficient penetration leads to a weak bonding of the layers, while excessive penetration reduces the geometrical accuracy. The prediction of the penetration behavior can be beneficial to set the process parameters for new material systems and to control the distribution of particles in the green part. This study presents a modeling approach for the determination of the penetration depth of particle-loaded inks in the binder jetting process on the basis of the sessile drop method. An additional process model was established that allowed the integration of the process parameters of the binder jetting procedure. The validation was performed by measuring the penetration depth of three inks with particle loads of 1 m%, 5 m%, and 10 m% into a spherical aluminum oxide powder. The comparison of the experimentally determined with the predicted penetration depths showed a good agreement for low particle loads. With higher particle loads, the deviations from the experimental data increased due to an accumulation of the particles on the top of the particle-loaded layer.