The paradigm of molecular discovery in the chemical and pharmaceutical industry has followed a repetitive succession of screening and synthesis, involving the analysis of individual molecules that were both natural and produced. This ability to generate and screen libraries of compounds has found an echo in solid-state physics with the demand to explore and produce new materials for testing. In response to this demand, a golden age of materials discovery is being developed, with progress on important areas of both basic science and device applications. The confluence of theoretical and simulation methods, together with the availability of computation resources, has established the “materials genome” approach that is used by a growing number of research groups around the world with the goal of innovating on materials through systematic discovery. In this Prospective, an overview of this group of methodologies in tackling the ever-increasing complexity of computational materials science simulations is provided. Computational simulation is highlighted as a major component of rational design and synthesis of new materials with targeted properties, describing progress on databases and large data treatment. Tools for new materials discovery, including progress on the deployment of new data repositories, the implementation of high-throughput simulation approaches, and the development of artificial intelligence algorithms, are discussed.

Natural systems displaying optical properties have for long been an inspiration for new classes of optical constructs. Using the same families of materials employed by Nature in combination with their directed assembly allows access to n-dimensions of control to, ultimately, generate optical systems with multiple coexisting functions. This review provides an overview of lab-made optical systems made of protein and polysaccharide-derived materials found in naturally occurring optical systems. Recent advances in optical biomimicry and bioinspired, polyfunctional optical structures are presented, addressing attributes such as sensing, edible devices, biologically activity, and resorbable optical formats.

This article presents a comprehensive overview of currently available research on bioimplantable energy harvesters, with a specific focus on their fabrication and issue of biocompatibility. Both the achievements and limitations of the field are pointed out from the standpoint of materials science and engineering as directions for future research. Particular attention is paid to the controversy over the use of lead-based or lead-free piezoelectric ceramics in biomedical applications, which is closely related to different temporalities of research on biological conditions. This report is intended to serve as a reference guide for developing the next generation of piezoelectric biomedical devices.

From thin film solar cells to metal–oxide–semiconductor (MOS) devices in leading edge integrated circuits, the electronic structure at and near the interfaces between component materials determines the most important fundamental operating characteristics of those devices such as turn-on voltage, power dissipation, and off-state current leakage. Fermi level location at buried interfaces, semiconductor (SC) band bending, charge transfer, oxide defects, and work functions of the constituent materials all contribute to device performance. This paper describes how these important parameters can be determined by employing femtosecond photovoltage spectroscopy, an extension of ultraviolet photoelectron spectroscopy (UPS) using ultrafast lasers. While standard UPS is fundamentally a surface-sensitive spectroscopy, pump/probe techniques add a new dimension to this venerable spectroscopy, permitting the accurate extraction of the underlying band bending in SCs. When combined with the valence band edge location of the SC and oxide, and determination of the system Fermi level, full characterization of the electronic structure of a MOS stack can be obtained providing key insights on device operating properties. This approach can be extended to study key device materials in emerging areas of artificial intelligence and quantum computing. In each case, surprising new details were uncovered that led to performance optimization of these technologically important devices.

The authors propose an alternative route to circumvent the limitation of neutron flux using the recent deep learning super-resolution technique. The feasibility of accelerating data collection has been demonstrated by using small-angle neutron scattering (SANS) data collected from the EQ-SANS instrument at Spallation Neutron Source (SNS). Data collection time can be reduced by increasing the size of binning of the detector pixels at the sacrifice of resolution. High-resolution scattering data is then reconstructed by using a deep learning-based super-resolution method. This will allow users to make critical decisions at a much earlier stage of data collection, which can accelerate the overall experimental workflow.

Recent discovery of ferroelectricity in doped HfO2 has reignited research interest in the ferroelectric field-effect transistor (FeFET) as emerging embedded nonvolatile memory with the potential for neuro-inspired computing. This paper reviews two major aspects for its application in neuro-inspired computing: ferroelectric devices as multilevel synaptic devices and the circuit primitive design with FeFET for in-memory computing. First, the authors survey representative FeFET-based synaptic devices. Then, the authors introduce 2T-1FeFET synaptic cell design that improves its in situ training accuracy to approach software baseline. Then, the authors introduce the FeFET drain–erase scheme for array-level operations, which makes the in situ training feasible for FeFET-based hardware accelerator. Finally, the authors give an outlook on the future 3D-integrated 2T-1FeFET design.

Because of their structural versatility, fast redox reactivity, high storage capacity, sustainability, and environmental friendliness, soluble organic redox molecules have emerged as materials that have potential for use in energy-storage systems. Considering these advantages, this paper reviews recent progress in implementing such materials in aqueous soluble organic redox flow batteries and organic alkali metal/air batteries. We identify and discuss major challenges associated with molecular structures, cell configurations, and electrochemical parameters. Hopefully, we provide a general guidance for the future development of soluble organic redox materials for emerging energy-storage devices used in the electricity grid.

The deeper comprehension of biological phenomena has led to the pursuit of designing and architecting complex biological systems. This has been incorporated through the advances in bioprinting of artificial organs and implants even at the microscale. In addition, tissue modeling has been employed to understand and prevent malfunctional and detrimental mechanisms that lead to fatal diseases. Furthermore, the endeavor to convey the mechanical properties of both scaffolds and cells has enabled the unveiling of disease modeling and regenerative medicine. This paper aims to provide a brief review of the design, modeling and characterization of conventional and architected structures employed in bioengineering.

Recent applications require vertical chip stacking to increase the performance of many devices without the need of advanced node components. Image sensors and vision systems will embed more and more smart functions, for instance, image processing, object recognition, and movement detection. In this perspective, the combination of Cu-to-Cu direct hybrid bonding technology with Through-Silicon-Via (TSV) will allow 3D interconnection between pixels and the associated computing and memory structures, each function fabricated on a separate wafer. Wafer-to-wafer hybrid bonding was achieved with multi-pitch design—1–4 μm—of single levels of Cu damascene patterned on 300 mm silicon substrates. Defect-free bonding, as far as the extreme edge of the wafer, was demonstrated on a stack with three wafers. Middle wafers thinning was done with grinding only and with a thickness uniformity (TTV) <2 μm to an ultimate thinning as low as 3 μm. Alignment performance was characterized by post-bonding for two superposed hybrid bonding interfaces. In our set of wafers, modeling the alignment with translation, rotation, and scaling components enables us to optimize the residuals down to 3σ < 100 nm. A process flow of thin TSV with a fine pitch of 2 μm for high-density vertical interconnect through a three-wafer stack was developed. Via-last TSV architecture was adopted with 1 μm TSV diameter and 10 μm thickness. Lithography, etching solutions, Ti/TiN barrier deposition, and void-free Cu filling solutions were demonstrated. TSV cross sections after CMP and connections with top and bottom Cu damascene lines show good profile control. Process developments are matured and can be reliably used in the fabrication of an electrical test vehicle including vertical interconnects associating multi-wafers stacking with a hybrid bonding process and high-density thin TSV applicable to low pitches (<5 μm).

This report is on the synthesis by electrospinning of multiferroic core-shell nanofibers of strontium hexaferrite and lead zirconate titanate or barium titanate and studies on magneto-electric (ME) coupling. Fibers with well-defined core–shell structures showed the order parameters in agreement with values for nanostructures. The strength of ME coupling measured by the magnetic field-induced polarization showed the fractional change in the remnant polarization as high as 21%. The ME voltage coefficient in H-assembled films showed the strong ME response for the zero magnetic bias field. Follow-up studies and potential avenues for enhancing the strength of ME coupling in the core–shell nanofibers are discussed.

In many materials development projects, scientists and research heads make decisions to guide the project direction. For example, scientists may decide which processing steps to use, what elements to include in their material selection, or from what suppliers to source their materials. Research heads may decide whether to invest development effort in reducing the environmental impact or production cost of a material. When making these decisions, it would be helpful to know how those decisions affect the achievable performance of the materials under consideration. Often, these decisions are complicated by trade-offs in performance between competing properties. This paper presents an approach for visualizing and evaluating design spaces, where a design space is defined as the set of possible materials under consideration given specified constraints. This design space visualization approach is applied to two case studies with environmental impact motivations: one in biodegradability for solvents, and the other in sustainable materials sourcing for Li-ion batteries. The results demonstrate how this visualization approach can enable data-driven, quantitative decisions for project direction.

Unconventional techniques to benefit from the low-cost and high-efficiency monocrystalline silicon solar cells can lead to new device capabilities and engineering prospects. Here, a nature-inspired spherical solar cell is demonstrated, which is capable of capturing light three-dimensionally. The proposed cell architecture is based on monocrystalline silicon and is fabricated using a corrugation technique. The spherical cell shows an increase in power output by up to 101% with respect to a traditional flat cell with the same projection area using different reflective materials. Finally, the spherical cell shows advantages in terms of enhanced heat dissipation and reduced dust accumulation over conventional cells.

To avoid degradation of silicon anodes in lithium-ion batteries (LIBs), the authors report a new two-dimensional multi-layered Si-intercalated rGO (rGO/Si) anode prepared by direct growth of Si into a porous multi-layered reduced graphene oxide (rGO) film. Direct Si deposition onto the porous rGO film allows the Si layers to be intercalated into the film via in situ replacement of the oxygen groups of the multi-layered graphene oxide (GO) with Si through thermal reduction of the GO film. The porous rGO acts as a cushion against the expansion of the Si layer during lithiation, preventing the Si from being pulverized and producing highly stable LIBs.

Bioelectronics aims to design electronic devices which can be fully integrated within tissues to monitor or stimulate specific cell functions. The main challenge is the engineering of the cell–chip interface and diverse materials, and devices have been developed to recapitulate biological architectures and functionalities. In this Prospective article, the authors give an overview on how the bioelectronics community has exploited biomimetic approaches to emulate cell morphologies, interactions, and functions to design optimal electrical platforms to be coupled to living cells.

Contact guidance is vital to many physiological processes, yet is still poorly understood. This is partly due to the variability of experimental platforms, making comparisons difficult. To combat this, a multiplexed approach was used to fabricate topographical cues on single quartz coverslips for high-throughput screening. Furthermore, this method offers control of surface roughness and protein adsorption characterization, two critical aspects to the in vitro environment often overlooked in contact guidance platforms. The quartz surface can be regenerated, is compatible with versatile microscopy modes, and can scale up for manufacturing offering a novel platform that could serve as a potential standard assay.

Conventional computed tomography (CT) remains the workhorse of cross-sectional medical imaging. But dual- and multi-energy CT allows for more specific material decomposition, enabling distinct advantages in the clinical setting. In this review, we describe the basic principles behind material decomposition in dual- and multi-energy CT, outline the techniques used to acquire images, and explore how enhanced material decomposition leads to improved patient care. We also explore areas of active research and future directions, including photon-counting CT, that have the potential to revolutionize CT in clinical use.

The current COVID-19 pandemic has caused the shortage of personal protective equipment (PPE) where improvised manufacturing in particular 3D printing has addressed many needs. This prospective discusses the current global crisis, then follows the wide interest in addressing the shortage of medical devices and PPEs used for treatment and protection against pathogens. An overview of the 3D printing process with polymer materials is given followed by the different 3D printing projects of PPEs and medical devices that emerged for the pandemic (including validation/testing). The potential for rapid prototyping with different polymer materials and eventual high-throughput production is emphasized.

Five Au complexes are evaluated for the reduction reaction of CO2 via cyclic voltammetry and in a photocatalytic system. Electrochemically, the complexes were all evaluated for pre-association with CO2 prior to electrochemical reduction and for thermodynamic favorability for CO2 reduction in photocatalytic systems. The complexes were evaluated in photocatalytic reactions using an Ir-based photosensitizer and a sacrificial electron donor for the conversion of CO2 to CO. Au-complex counterion effects on the photocatalytic reaction were analyzed by varying weakly coordinating counterions with significant performance changes noted. At low Au-complex concentrations, a high TON value of 700 was observed.

From the 1918 influenza pandemic (H1N1) until the recent 2019 severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) pandemic, no efficient diagnostic tools have been developed for sensitive identification of viral pathogens. Rigorous, early, and accurate detection of viral pathogens is not only linked to preventing transmission but also to timely treatment and monitoring of drug resistance. Reverse transcription-polymerase chain reaction (RT-PCR), the gold standard method for microbiology and virology testing, suffers from both false-negative and false-positive results arising from the detection limit, contamination of samples/templates, exponential DNA amplification, and variation of viral ribonucleic acid sequences within a single individual during the course of the infection. Rapid, sensitive, and label-free detection of SARS-CoV-2 can provide a first line of defense against the current pandemic. A promising technique is non-linear coherent anti-Stokes Raman scattering (CARS) microscopy, which has the ability to capture rich spatiotemporal structural and functional information at a high acquisition speed in a label-free manner from a biological system. Raman scattering is a process in which the distinctive spectral signatures associated with light-sample interaction provide information on the chemical composition of the sample. In this prospective, we briefly discuss the development and future prospects of CARS for real-time multiplexed label-free detection of SARS-CoV-2 pathogens.

From being an unfavorable consequence to finding itself as the intended imaginary part of a non-Hermitian system, loss has truly emerged as more of a friend than a foe in the context of acoustic metasurfaces. With the promising features of sub-wavelength geometries and the rapid advances in manufacturing techniques that can enable their realization, loss becomes a central topic of discussion. Further, the capability of introducing and tailoring loss allows it to serve as a new degree of freedom in passive wavefront shaping devices. In this review, the authors look back at the recent progress in the field of lossy acoustic metasurfaces. The background behind loss in deep sub-wavelength geometries and the instinctive responses to treat them and exploit them are overviewed, followed by more recent works that embrace and tailor their behavior for unconventional applications. The forthcoming years for acoustic metasurfaces thus hold several promising avenues for exploration, with loss as the protagonist.