Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “functional materials”

Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 739 records · Page 41
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Pushing Cu uphill of the volcano curve: Impact of a WC support on the catalytic activity of copper toward the hydrogen evolution reaction

Here, the adsorption of atomic H and H 2 on copper mono- and submonolayers supported on hexagonal WC(0001) surfaces has been investigated using density functional theory with the Perdew–Burke–Ernzerhof exchange correlation functional and D2 van der Waals corrections. Results evidence the impact of the termination of the carbide substrate on fundamental properties of Cu adatoms, and, hence, on the stability of molecular and atomic hydrogen, defining copper's catalytic activity for hydrogen evolution reaction. Using H adsorption energy as a descriptor, catalytic activity of Cu adlayers for hydrogen evolution reaction was estimated using traditional volcano curves and a curve, obtained at low hydrogen coverage. Obtained results evidence that copper adlayers supported on the WC may present a viable low-cost alternative to noble metal-based catalysts, with improved catalytic activity compared to that of copper. This, potentially, can be a useful basis for designing and developing novel functional materials with predetermined catalytic properties.

08 HYDROGEN↗
DOE OSTI2025

Integrated CO 2 capture and hydrogenation in presence of Ru–Na 2 ZrO 3 : An in-situ study

Integrated CO 2 capture and conversion (ICCC) by hydrogenation is a promising strategy to utilize carbon dioxide and this work add to the effort to elucidate the catalytic hydrogenation mechanism using Ru based dual functional materials (DFM). Ru-Na 2 ZrO 3 DFMs, obtained through different wet methods, were evaluated for the first time and the relationship between Ru and support systematically investigated. The thermally stable and cyclable Ru-Na 2 ZrO 3 -a (obtained without filtration step) exhibited CO 2 conversion of 80% and a higher yield of CO at 400°C compared to previously tested DFM, while the Na depleted/Zr rich Ru-Na 2 ZrO 3 -b resulted in 90% selectivity to CH 4 with yield of 1.11 mmol/g at the same temperature. The in-situ experiments have provided conclusive evidence showing that CO 2 hydrogenation on the two Ru DFMs is fundamentally different. In Ru-Na 2 ZrO 3 -a, the monoclinic Na 2 ZrO 3 support acted as the active centre (not as promoter) for CO 2 bridging binding and hydrogenation to CH 4 at the metal-support interface through associative formate pathway with limited further reduction to methane due to lack of H 2 spillover from the small and well dispersed Ru NPs, which results in CO desorption. Conversely, abundant clusters of larger Ru NPs in Ru-Na 2 ZrO 3 -b, led to CH 4 production due to co-existent Ru on-top direct dissociation of CO 2 (preferential) and monodentate formate adsorption and further methanation. Alkali zirconates doped metals, and their synthesis method could thus play a crucial role in designing tuneable heterogeneous catalysis in C 1 chemistry, which could significantly benefit the environment by lowering CO 2 levels, encouraging cleaner industrial practices, supporting a circular economy, and converting waste CO 2 into valuable products.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Automated Voxel-Based Analysis of Volumetric Dynamic Contrast-Enhanced CT Data Improves Measurement of Serial Changes in Tumor Vascular Biomarkers

Objectives: Development of perfusion imaging as a biomarker requires more robust methodologies for quantification of tumor physiology that allow assessment of volumetric tumor heterogeneity over time. This study proposes a parametric method for automatically analyzing perfused tissue from volumetric dynamic contrast-enhanced (DCE) computed tomography (CT) scans and assesses whether this 4-dimensional (4D) DCE approach is more robust and accurate than conventional, region-of-interest (ROI)-based CT methods in quantifying tumor perfusion with preliminary evaluation in metastatic brain cancer. Methods and Materials: Functional parameter reproducibility and analysis of sensitivity to imaging resolution and arterial input function were evaluated in image sets acquired from a 320-slice CT with a controlled flow phantom and patients with brain metastases, whose treatments were planned for stereotactic radiation surgery and who consented to a research ethics board-approved prospective imaging biomarker study. A voxel-based temporal dynamic analysis (TDA) methodology was used at baseline, at day 7, and at day 20 after treatment. The ability to detect changes in kinetic parameter maps in clinical data sets was investigated for both 4D TDA and conventional 2D ROI-based analysis methods. Results: A total of 7 brain metastases in 3 patients were evaluated over the 3 time points. The 4D TDA method showed improved spatial efficacy and accuracy of perfusion parameters compared to ROI-based DCE analysis (P<.005), with a reproducibility error of less than 2% when tested with DCE phantom data. Clinically, changes in transfer constant from the blood plasma into the extracellular extravascular space (K{sub trans}) were seen when using TDA, with substantially smaller errors than the 2D method on both day 7 post radiation surgery (±13%; P<.05) and by day 20 (±12%; P<.04). Standard methods showed a decrease in K{sub trans} but with large uncertainty (111.6 ± 150.5) %. Conclusions: Parametric voxel-based analysis of 4D DCE CT data resulted in greater accuracy and reliability in measuring changes in perfusion CT-based kinetic metrics, which have the potential to be used as biomarkers in patients with metastatic brain cancer.

62 RADIOLOGY AND NUCLEAR MEDICINE↗
DOE OSTI2022

The role of amorphous ZIF in ZIF-8 crystallization kinetics and morphology

Understanding the composition and structure of amorphous precursor phases is fundamental for elucidating two-step crystallization mechanisms and designing shape- and size-controlled nanomaterials. However, that understanding is largely lacking for metal–organic framework compounds despite their growing significance as functional materials. Here, in this study, we report the crystallization of zeolite imidazolate frameworks-8 (ZIF-8, Zn(C 4 H 5 N 2 ) 2 ) via an amorphous ZIF (am-ZIF) solid precursor phase with a rough stoichiometric composition of Zn(C 4 H 5 N 2 ) 1.78 (C 4 H 6 N 2 ) 0.17 (CH 3 COO) 0.22 . The formation of am-ZIF is attributed to the incomplete deprotonation of 2-Methylimidazole (HmIm) and the involvement of the hydrogen bond between CH 3 COO– and –HN, which can further transform into the dense Dia(Zn) structure with a diamondoid crystal topology in pure water. Taking am-ZIF as a precursor, the tunable dissolution and recrystallization kinetics of am-ZIF into ZIF-8, due to the addition of EtOH and CTAB, allows the selective fabrication of dodecahedral, cubic, and hollow ZIF-8. Overall, an in-depth understanding of the differences in composition and structure of am-ZIF from ZIF-8 and the resulting crystallization kinetics suggests a novel approach to designing metal–organic frameworks with controlled crystal morphology.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Ab initio study of tungsten-based alloys under fusion power-plant conditions

Tungsten (W) is considered a leading candidate for structural and functional materials in future fusion energy devices. The most attractive properties of tungsten for magnetic and inertial fusion energy reactors are its high melting point, high thermal conductivity, low sputtering yield, and low long-term disposal radioactive footprint. However, tungsten also presents a very low fracture toughness, primarily associated with intergranular failure and bulk plasticity, limiting its applications. In recent years, several families of tungsten-based alloys have been explored to overcome the aforementioned limitations of pure tungsten. These include tungsten-based high-entropy alloys (W-HEAs) and tungsten-based Self-passivating Metal Alloys with Reduced Thermo-oxidation or “SMART alloys” (W-SAs). Given their proximity to the plasma, it is crucial to understand how the exposure of these candidate plasma-facing materials (PFMs) to the neutron fluxes expected in fusion reactors impacts their material behavior over time. In this work, we present a computational approach that combines inventory codes and first-principles DFT electronic structure calculations to understand the behavior of transmuting tungsten-based PFMs. In particular, we calculate the changes in the chemical composition, production uncertainties, the elastic and ductility properties, and the density of states for five tungsten-based PFMs when exposed to EU-DEMO fusion first wall conditions for ten years.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2023

Adaptive learning-driven high-throughput synthesis of oxygen reduction reaction Fe–N–C electrocatalysts

Reducing human reliance on inefficient energy systems and fossil fuels has become more urgent due to the consequences of global climate change. However, traditional trial-and-error approaches have hampered our ability to accelerate the discovery and implementation of functional materials for efficient energy conversion devices, such as polymer electrolyte fuel cells (PEFCs). To address this, we develop an adaptive learning framework that integrates machine learning and state-of-the-art capabilities in high-throughput synthesis to achieve expedited optimization of iron-nitrogen-carbon PEFC oxygen reduction reaction (ORR) electrocatalysts. We use statistical inference, uncertainty quantification, and global optimization to build a computational design-of-experiment tool that identifies the optimum compositions to be investigated next to reduce the demands placed on experimental materials discovery. We benchmark the ability of the proposed strategy to discover optimum catalyst synthesis conditions in a six-dimensional search space when starting with a thirty-six-sample database. By following the adaptive learning strategy, we synthesize fourteen new catalysts from approximately ten billion unique compositions and discover four catalysts that outperform all original samples. The best machine learning-optimized catalyst is 33% more active than the highest-performing one in the initial database, showing an ORR activity seven times larger than those typically reported for the same class of materials.

36 MATERIALS SCIENCE↗
DOE OSTI2011

Hierarchical Ag/ZnO micro/nanostructure: Green synthesis and enhanced photocatalytic performance

Ag/ZnO metal-semiconductor nanocomposites with hierarchical micro/nanostructure have been prepared by the hydrothermal synthesis in the presence of bovine serum albumin (BSA). The results suggest that this biomolecule-assisted hydrothermal method is an efficient route for the fabrication of Ag/ZnO nanocomposites by using BSA both a shape controller and a reducing agent of Ag{sup +} ions. Moreover, Ag nanoparticles on the ZnO act as electron sinks, improving the separation of photogenerated electrons and holes, increasing the surface hydroxyl contents of ZnO, facilitating trapping the photoinduced electrons and holes to form more active hydroxyl radicals, and thus, enhancing the photocatalytic efficiency of ZnO. This is a good example for the organic combination of green chemistry and functional materials. -- Graphical Abstract: A green strategy is report to construct Ag/ZnO metal-semiconductor nanocomposites with hierarchical micro/nanostructure and enhanced photocatalytic activity. Display Omitted Research highlights: > Hierarchical micro/nanostructured Ag/ZnO nanocomposites have been prepared via a green route. > Ag nanoparticles improve the separation of photogenerated electrons and holes. > This facilitates trapping the photoinduced electrons and holes to form more hydroxyl radicals. Therefore, it enhances the photocatalytic efficiency of ZnO.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

Morphology-controlled synthesis of Ti{sup 3+} self-doped yolk–shell structure titanium oxide with superior photocatalytic activity under visible light

Ti{sup 3+} self-doped yolk–shell structure titanium oxide nanoparticle aggregates are fabricated through an environmental template-free route and the reduction reaction at low temperature subsequently. After the Ti{sup 3+} doping, the reduced TiO{sub 2} sample exhibits a wide visible-light absorption ranged from 400 nm to 800 nm. The intrinsic hollow core–shell microstructure can make multiple reflections of light within the chamber, and thus results in more efficient use of the light source compared with solid structure. Besides, the large surface area can render the sample with a high activity. Therefore, Ti{sup 3+} self-doped yolk–shell structure titanium oxide exhibits a superior photocatalytic activity under visible light. This strategy is simple, cheap and mass-productive, which may shed light on a new avenue for large scale production of self-doped yolk–shell structural nano functional materials for catalyst, sensors, energy storage and other new applications. - Graphical abstract: A facile generic strategy is employed to prepare Ti{sup 3+} self-doped yolk–shell structure titanium oxide nanoparticle aggregates with the superior photocatalytic activity under visible light. - Highlights: • Yolk–shell TiO{sub 2} mesospheres are synthesized by solvothermal alcoholysis. • Ti{sup 3+} self-doped yolk–shell structure titanium oxide is obtained at low temperature. • It exhibits a remarkable photocatalytic activity.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2015

Magnetic properties and adsorptive performance of manganese–zinc ferrites/activated carbon nanocomposites

Owing to the unique microstructure and high specific surface area, activated carbon (AC) could act as an excellent adsorbent for wastewater treatment and good carrier for functional materials. In this paper, manganese–zinc ferrites (Mn{sub 0.5}Zn{sub 0.5}Fe{sub 2}O{sub 4}: MZF) were anchored into AC by hydrothermal method, resulting in the excellent magnetic response for AC nanocomposites in wastewater treatment. All results demonstrated the magnetic nanoparticles presented a spinel phase structure and existed in the pores of AC. The saturation magnetization (Ms) of MZF/AC nanocomposites increased with the ferrites content, while the pore volume and specific surface area declined. The Sample-5 possessed the specific surface area of 1129 m{sup 2} g{sup −1} (close to 1243 m{sup 2} g{sup −1} of AC) and Ms of 3.96 emu g{sup −1}. Furthermore, the adsorptive performance for organic dyes was studied and 99% methylene blue was adsorbed in 30 min. The magnetic AC nanocomposites could be separated easily from solution by magnetic separation technique. - Graphical abstract: The Sample-5 presented both good magnetic response and high BET surface area up to 1129 m{sup 2} g{sup −1} (close to AC of 1243 m{sup 2} g{sup −1}), which could be separated completely for about 60 s. MZF/AC nanocomposites (Sample-3, 4, 5) in our work could be used as the magnetic absorbents, which could be separated easily by an outer magnet after the MB adsorption. - Highlights: • Mn{sub 0.5}Zn{sub 0.5}Fe{sub 2}O{sub 4} (MZF) as few as possible was implanted into activated carbon (AC) for the higher surface area. • Sample-5 possessed the high specific surface area (1129 m{sup 2} g{sup −1}) and the suitable Ms (3.96 emu g{sup −1}). • Methylene blue was adsorbed almost completely by MZF/AC nanocomposites in 30 min. • MZF/AC nanocomposites were separated easily from solution by magnetic separation technique.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2018

Fe incorporation into hydroxyapatite channels by Fe loading and post-annealing

Apatite-type solid solutions with the formula Ca{sub 10}(PO{sub 4}){sub 6}Fe{sub x}O{sub y}H{sub z} containing Fe atoms in the channel sites of Ca{sub 10}(PO{sub 4}){sub 6}(OH){sub 2} were successfully synthesized by impregnation with aqueous solution of Fe, followed by heat treatment at 1150 °C in air and cooling to room temperature. The unit cell volume of Ca{sub 10}(PO{sub 4}){sub 6}Fe{sub x}O{sub y}H{sub z} increased with increasing Fe content. The results of structural refinement using powder X-ray diffraction data and Raman spectroscopy suggested that the incorporated Fe ions occupied four-fold sites, away from the center of the channel in the apatite lattice. This method may be useful for synthesizing novel apatite-type functional materials containing transition metals.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

On the importance of FIB-SEM specific segmentation algorithms for porous media

A new algorithmic approach to segmentation of highly porous three dimensional image data gained by focused ion beam tomography is described which extends the key-principle of local threshold backpropagation described in Salzer et al. (2012). The technique of focused ion beam tomography has shown to be capable of imaging the microstructure of functional materials. In order to perform a quantitative analysis on the corresponding microstructure a segmentation task needs to be performed. However, algorithmic segmentation of images obtained with focused ion beam tomography is a challenging problem for highly porous materials if filling the pore phase, e.g. with epoxy resin, is difficult. The gray intensities of individual voxels are not sufficient to determine the phase represented by them and usual thresholding methods are not applicable. We thus propose a new approach to segmentation that pays respect to the specifics of the imaging process of focused ion beam tomography. As an application of our approach, the segmentation of three dimensional images for a cathode material used in polymer electrolyte membrane fuel cells is discussed. We show that our approach preserves significantly more of the original nanostructure than a thresholding approach. - Highlights: • We describe a new approach to the segmentation of FIB-SEM images of porous media. • The first and last occurrences of structures are detected by analysing the z-profiles. • The algorithm is validated by comparing it to a manual segmentation. • The new approach shows significantly less artifacts than a thresholding approach. • A structural analysis also shows improved results for the obtained microstructure.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Microstructure and transformation behavior of Ni{sub 24.7}Ti{sub 50.3}Pd{sub 25} high temperature shape-memory alloy with Sc micro-addition

NiTiPd shape-memory alloys (SMAs) are potential functional materials for use as solid-state actuators in the temperature range 100–250 °C. The present study investigates the effect of 1.0 at.% Sc micro-addition to Ni{sub 24.7}Ti{sub 50.3}Pd{sub 25} alloy, Sc replacing either Ti or Ni. Results show that all the three alloys studied have stable transformation behavior on stress-free thermal cycling and hence, are suitable for cyclic actuation applications. However, the addition of Sc to NiTiPd alloy leads to decrease of transformation temperatures, the magnitude of decrease being greater for the alloy with Sc replacing Ni. The martensite finish (M{sub f}) temperature of 181 °C for the NiTiPd alloy decreased to 139 °C for Sc replacing Ti and 83 °C for Sc replacing Ni. Also, the indentation modulus of NiTiPdSc (Sc replacing Ni) alloy is found to be significantly low compared to the other alloys. Analysis indicates that the observed differences in the alloy properties are related to the solubility of Sc in the NiTiPd matrix. While the quaternary NiTiPdSc alloy, Sc replacing Ti, has a single phase microstructure, the alloy with Sc replacing Ni shows the presence of Sc-rich and TiPd-type second phases in the microstructure. TEM examination revealed that the TiPd-type phase has a distinct rod-like morphology (30–50 nm) arranged in a grid-like structure. The transformation and indentation behavior of the alloys is elucidated using thermodynamic calculations of frictional energy and an electronic structure based analysis. - Highlights: • TEM of Ni{sub 23.7}Ti{sub 50.3}Pd{sub 25}Sc{sub 1} showed distinct grid of TiPd-type phase nanorods < 50 nm. • Stress-free thermal cycling of all the three alloys showed stable transformation behavior. • Ni{sub 24.7}Ti{sub 49.3}Pd{sub 25}Sc{sub 1} and Ni{sub 23.7}Ti{sub 50.3}Pd{sub 25}Sc{sub 1} showed single and multiphase structures. • Sc micro-addition (1 at.%) to Ni{sub 24.7}Ti{sub 50.3}Pd{sub 25} alloy decreased TTs significantly. • Ni{sub 23.7}Ti{sub 50.3}Pd{sub 25}Sc{sub 1} exhibited lower modulus of 67 GPa to 85 GPa of Ni{sub 24.7}Ti{sub 50.3}Pd{sub 25}.

36 MATERIALS SCIENCE↗
DOE OSTI2018

The shape recovery conditions for Fe–Mn–Si alloys: An interplay between martensitic transformation and plasticity

Highlights: • Fe15Mn5Si9Cr5Ni samples were rolled at 800 °C and annealed at 650 (C1) and 1000 °C (C2). • TEM analysis was performed. • High density of stacking faults and appropriate density of dislocation appears in C1. • Complex dislocation arrays due to plastic deformation are observed in C2. • Shape memory properties depend on the thermomechanical treatment. - Abstract: This work analyses the improvement of the shape memory properties of Fe-Mn-Si based alloys, and expands upon and deepens recently published developments concerning this topic. We prepared TEM specimens from a Fe-15Mn-5Si-9Cr-5Ni sheet rolled at 800 °C and annealed at 650 °C–92% shape recovery – and from another sheet annealed at 1000 °C–45% shape recovery. Here, we analyse the development of microstructure during the γ ↔ ε martensitic transformation and correlate it with the shape memory behaviour. Among the observed microstructural features, the introduction of complex dislocation arrays due to plastic deformation appears to be critical for shape memory development, since they can arrest the backward movement of Shockley partial dislocations over the original path. Tailoring the microstructure in order to introduce a high stacking-fault density accompanied by an appropriate dislocation density remains a key issue in the design of these kinds of functional materials.

36 MATERIALS SCIENCE↗
DOE OSTI2023

A simple, validated approach for design of two-dimensional periodic particle patterns via acoustophoresis

Two-dimensional patterning of microparticles enables a wide range of functional materials, including patterned energy storage electrodes, flexible electronics, and sensor arrays. Particle patterning via acoustics offers an attractive path to generate a wide variety of 2D periodic patterns that introduce tailorable hierarchical porosity, useful for controlling surface area, transport distances, and other properties. This method is most effective with micron scale particles and patterns of tens to hundreds of microns. To enable systematic exploration of the broad design space for such patterns, this work develops a model of 2D and 3D assembly of particles at high loadings and validates the obtained patterns against both experiments and more computationally intensive modeling techniques. Using this simple model, connections are mapped between input parameters (like actuation conditions, particle volume fraction, material properties) and output geometrical features (like void size and shape, pattern connectivity, and surface area) so that they can be tailored to given applications. The utility of this simple model is illustrated by predicting and then experimentally demonstrating new hierarchical patterns resulting from multiple waves of different frequencies interacting. These multiscale patterns offer the potential to lift the limits on surface area, diffusion distances, and other features.

42 ENGINEERING↗
DOE OSTI2011

Formation of novel morphologies of aragonite induced by inorganic template

Graphical abstract: Glass-slices were used as a template to induce formation and assembly of aragonite. Different morphologies, such as hemisphere, twinborn hemisphere and flower-shaped particles, were produced by direction of the glass-slices. Highlights: {yields} Glass-slices were used as a template to induce formation and assembly of aragonite. {yields} Hemisphere, twinborn hemisphere and flower-shaped particles were produced by direction of the glass-slices. {yields} Planes were always appeared in these as-synthesized samples. {yields} Thermodynamic theory was applied to explain the production of the aragonite. -- Abstract: A glass-slice was used as a template to induce formation and assembly of aragonite. Thermodynamic theory was applied to explain the production of the aragonite. Transformation of three-dimensional nucleation to template-based two-dimensional surface nucleation caused the production of aragonite. Hemisphere, twinborn hemisphere and flower-shaped particles were produced by direction of the glass-slices. Planes were always appeared in these as-synthesized samples because the nucleation and the growth of these samples were adsorbed at the surfaces of the glass-slices. The formation mechanism of the as-formed sample was proposed. Compared with organic template, the present study provides a facile method to apply inorganic template to prepare functional materials.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Rational fabrication of nickel hydroxide shell on TiO{sub 2} nanorod core forming enhanced arrays for energy storage

Highlights: • Construct TiO{sub 2}/Ni(OH){sub 2} core/shell arrays by ALD-assisted HS method. • Ni(OH){sub 2} nanoflake shells show high energy storage. • Porous core/shell structure is favorable for fast ion/electron transfer. - Abstract: Integration of different functional materials into core/shell composite arrays is of great importance for high-performance energy storage. In this work, we controllably synthesize Ni(OH){sub 2} nanoflake shell on the single-crystalline TiO{sub 2} nanorod cores forming composite core/shell arrays (CSAs). Interconnected Ni(OH){sub 2} nanoflakes of 20–30 nm are uniformly coated on the TiO{sub 2} nanorods of 80–120 nm via atomic layer deposition assisted hydrothermal method. Furthermore, porous network with numerous nanopores and large surface area is formed in this core/shell structure. In view of this advantageous architecture, the designed Ni(OH){sub 2}/TiO{sub 2} CSAs are studied as cathode of alkaline batteries and show high energy storage performance with a capacity of 121 mAh g{sup −1} at 1 A g{sup −1} and 91 mAh g{sup −1} at 5 A g{sup −1}, respectively. The boosted electrochemical properties are owing to the porous core/shell architecture with improved active area and accelerated ion/electron transfer characteristics.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Shape memory effect in metallic glasses

Shape memory effect (SME), mainly present in crystalline Ti-Ni alloys, is basically missing in metallic glasses (MGs) that lack the long-range periodic order of crystals. In this work, we report experimental results of SME in annealed MGs, in which the low-energy configuration state recovery is observed by both differential scanning calorimetry and X-ray photon correlation spectroscopy. We elucidate the origin of SME in MGs under the potential energy landscape framework, i.e., after annealing, the energy of MGs enters into a deep basin and atoms are located in the low-energy configuration state. Albeit deviating from their relative stable configurations by temperature changes, atoms in the annealed MGs tend to return to the low-energy atomic configurations along certain trajectories as pre-annealing temperature is approached, These results could extend the application of MGs as functional materials by directionally manipulating their energy states via annealing and rejuvenation.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Anisotropic optical and magnetic response in self-assembled TiN–CoFe 2 nanocomposites

Transition metal nitrides (e.g., TiN) have shown tremendous promise in optical metamaterials for nanophotonic devices due to their plasmonic properties comparable to noble metals and superior high temperature stability. Vertically aligned nanocomposites (VANs) offer a great platform for combining two dissimilar functional materials with a one-step deposition technique toward multifunctionality integration and strong structural/property anisotropy. Here, we report a two-phase nanocomposite design combining ferromagnetic CoFe 2 nanosheets in the plasmonic TiN matrix as a new hybrid plasmonic metamaterial. The hybrid metamaterials exhibit anisotropic optical and magnetic responses, as well as a pronounced magneto-optical coupling response evidenced by Magneto-optic Kerr Effect measurement, owing to the novel vertically aligned structure. This work demonstrates a new TiN-based metamaterial with anisotropic properties and multifunctionality toward light polarization modulation, optical switching, and integrated optics.

36 MATERIALS SCIENCE↗