Dislocation flow turbulence simultaneously enhances strength and ductility.

Multi-principal element alloys (MPEAs) exhibit outstanding strength attributed to the complex dislocation dynamics as compared to conventional alloys. Here, we develop an atomic-lattice-distortion-dependent discrete dislocation dynamics framework consisted of random field theory and phenomenological dislocation model to investigate the fundamental deformation mechanism underlying massive dislocation motions in body-centered cubic MPEA. Amazingly, the turbulence of dislocation speed is identified in light of strong heterogeneous lattice strain field caused by short-range ordering. Importantly, the vortex from dislocation flow turbulence not only acts as an effective source to initiate dislocation multiplication but also induces the strong local pinning trap to block dislocation movement, thus breaking the strength-ductility trade-off.

Additively Manufactured Dual-Faced Structured Fabric for Shape-Adaptive Protection.

Fabric-based materials have demonstrated promise for high-performance wearable applications but are currently restricted by their deficient mechanical properties. Here, this work leverages the design freedom offered by additive manufacturing and a novel interlocking pattern to for the first time fabricate a dual-faced chain mail structure consisting of 3D re-entrant unit cells. The flexible structured fabric demonstrates high specific energy absorption and specific strength of up to 1530 J kg-1 and 5900 Nm kg-1 , respectively, together with an excellent recovery ratio of ≈80%, thereby overcoming the strength-recoverability trade-off. The designed dual-faced structured fabric compares favorably against a wide range of materials proposed for wearable applications, attributed to the synergetic strengthening of the energy-absorbing re-entrant unit cells and their unique topological interlocking. This work advocates the combined design of energy-absorbing unit cells and their interlocking to extend the application prospects of fabric-based materials to shape-adaptive protection.

Strong yet Ductile High Entropy Alloy Derived Nanostructured Cermet.

Cermet is an important composite composed of ceramics and metals, which has widespread engineering applications but is notoriously known for its poor ductility. This work synthesizes freestanding cermet nanosheets through the reaction of high entropy alloy nanocrystals with the molecular structure of poly-vinyl alcohol, which results in a unique nanostructure consisting of metallic nanocrystals surrounded by complex amorphous ceramics. Atomic force microscopy indentation shows that such a high entropy alloy derived cermet is strong and tough at ambient temperature with a superb strength (∼3.2 GPa) and excellent ductility (∼50%), therefore overcoming the long-standing issue of brittleness facing conventional cermets.

Microstructure and Properties of a Graphene Reinforced Cu-Cr-Mg Composite.

To improve the graphene/copper interfacial bonding and the strength of the copper matrix, Cu-Cr-Mg alloy powder and graphene nanosheets (GNPs) have been used as raw materials in the preparation of a layered graphene/Cu-Cr-Mg composite through high-energy ball-milling and fast hot-pressing sintering. The microstructure of the composite after sintering, as well as the effect of graphene on the mechanical properties and conductivity of the composite, are also studied. The results show that the tensile strength of the composite material reached a value of 349 MPa, which is 46% higher than that of the copper matrix, and the reinforcement efficiency of graphene is as large as 136. Furthermore, the electrical conductivity of the composite material was 81.6% IACS, which is only 0.90% IACS lower than that of the copper matrix. The Cr and Mg elements are found to diffuse to the interface of the graphene/copper composite during sintering, and finely dispersed chromium carbide particles are found to significantly improve the interfacial bonding strength of the composite. Thus, graphene could effectively improve the mechanical properties of the composite while maintaining a high electrical conductivity.

Metal-carbide eutectics with multiprincipal elements make superrefractory alloys.

Materials with excellent high-temperature strength are now sought for applications in hypersonics, fusion reactors, and aerospace technologies. Conventional alloys and eutectic multiprincipal-element alloys (MPEAs) exhibit insufficient strengths at high temperatures due to low melting points and microstructural instabilities. Here, we report a strategy to achieve exceptional high-temperature microstructural stability and strength by introducing eutectic carbide in a refractory MPEA. The synergistic strengthening effects from the multiprincipal-element mixing and strong dislocation blocking at the interwoven metal-carbide interface make the eutectic MPEA not only have outstanding high-temperature strength (>2 GPa at 1473 K) but also alleviate the room-temperature brittleness through microcrack tip blunting by layered metallic phase. This strategy offers a paradigm for the design of the next-generation high-temperature materials to bypass the low-melting point limitation of eutectic alloys and diffusion-dominated softening in conventional superalloys.

Heterogeneous lattice strain strengthening in severely distorted crystalline solids.

Multi-principal element alloys (MPEAs) exhibit outstanding mechanical properties because the core effect of severe atomic lattice distortion is distinctly different from that of traditional alloys. However, at the mesoscopic scale the underlying physics for the abundant dislocation activities responsible for strength-ductility synergy has not been uncovered. While the Eshelby mean-field approaches become insufficient to tackle yielding and plasticity in severely distorted crystalline solids, here we develop a three-dimensional discrete dislocation dynamics simulation approach by taking into account the experimentally measured lattice strain field from a model FeCoCrNiMn MPEA to explore the heterogeneous strain-induced strengthening mechanisms. Our results reveal that the heterogeneous lattice strain causes unusual dislocation behaviors (i.e., multiple kinks/jogs and bidirectional cross slips), resulting in the strengthening mechanisms that underpin the strength-ductility synergy. The outcome of our research sheds important insights into the design of strong yet ductile distorted crystalline solids, such as high-entropy alloys and high-entropy ceramics.

Performance-oriented multistage design for multi-principal element alloys with low cost yet high efficiency.

Multi-principal element alloys (MPEAs) with remarkable performances possess great potential as structural, functional, and smart materials. However, their efficient performance-orientated design in a wide range of compositions and types is an extremely challenging issue, because of properties strongly dependent upon the composition and composition-dominated microstructure. Here, we propose a multistage-design approach integrating machine learning, physical laws and a mathematical model for developing the desired-property MPEAs in a very time-efficient way. Compared to the existing physical model- or machine-learning-assisted material development, the forward-and-inverse problems, including identifying the target property and unearthing the optimal composition, can be tackled with better efficiency and higher accuracy using our proposed avenue, which defeats the one-step component-performance design strategy by multistage-design coupling constraints. Furthermore, we developed a new multi-phase MPEA at the minimal time and cost, whose high strength-ductility synergy exceeded those of its system and subsystem reported so far by searching for the optimal combination of phase fraction and composition. The present work suggests that the property-guided composition and microstructure are precisely tailored through the newly built approach with significant reductions of the development period and cost, which is readily extendable to other multi-principal element materials.

Machine Learning-Based Strength Prediction for Refractory High-Entropy Alloys of the Al-Cr-Nb-Ti-V-Zr System.

The aim of this work was to provide a guidance to the prediction and design of high-entropy alloys with good performance. New promising compositions of refractory high-entropy alloys with the desired phase composition and mechanical properties (yield strength) have been predicted using a combination of machine learning, phenomenological rules and CALPHAD modeling. The yield strength prediction in a wide range of temperatures (20-800 °C) was made using a surrogate model based on a support-vector machine algorithm. The yield strength at 20 °C and 600 °C was predicted quite precisely (the average prediction error was 11% and 13.5%, respectively) with a decrease in the precision to slightly higher than 20% at 800 °C. An Al13Cr12Nb20Ti20V35 alloy with an excellent combination of ductility and yield strength at 20 °C (16.6% and 1295 MPa, respectively) and at 800 °C (more 50% and 898 MPa, respectively) was produced based on the prediction.

Microstructure and Mechanical Properties of TaNbVTiAlx Refractory High-Entropy Alloys.

A series of TaNbVTiAlx (x = 0, 0.2, 0.4, 0.6, 0.8, and 1.0) refractory high-entropy alloys (RHEAs) with high specific strength and reasonable plasticity were prepared using powder metallurgy (P/M) technology. This paper studied their microstructure and compression properties. The results show that all the TaNbVTiAlx RHEAs exhibited a single BCC solid solution microstructure with no elemental segregation. The P/M TaNbVTiAlx RHEAs showed excellent room-temperature specific strength (207.11 MPa*cm3/g) and high-temperature specific strength (88.37 MPa*cm3/g at 900 °C and 16.03 MPa*cm3/g at 1200 °C), with reasonable plasticity, suggesting that these RHEAs have potential to be applied at temperatures >1200 °C. The reasons for the excellent mechanical properties of P/M TaNbVTiAl0.2 RHEA were the uniform microstructure and solid solution strengthening effect.

Molecular dynamics simulations for nanoindentation response of nanotwinned FeNiCrCoCu high entropy alloy.

Twin boundary (TB) plays an important role on the plastic deformation of high entropy alloy (HEA). The strong effects of TB on the deformation response of HEA are revealed from atomic level based on the defect structure, shear strain and surface morphology, by comparing the nanoindentation behavior of nanotwinned FeNiCrCoCu HEA (nt-HEA) and single-crystal FeNiCrCoCu HEA (single-HEA). The plastic deformation of nt-HEA is mainly dominated by the dislocations slip confined by first twinning layer, the TB migration, the dislocation nucleation at TB and the stacking fault tetrahedron (SFT) formation, while the dislocation loop emission is the main plastic deformation feature of single-HEA. Compared to the case for single-HEA, the nanoindentation induces more dislocations in nt-HEA. The shear strain in nt-HEA mainly distributes in the first twinning layer, due to the obstacle effect of TB. The shear zone is larger in nt-HEA, and the distribution of shear strain on the nt-HEA surface is more symmetric. The nanoindentation generates fewer steps on the nt-HEA surface, and then brings about a relatively smooth surface for nt-HEA. These findings provide an insight into the TB effect on the nanoindentation response of FeNiCrCoCu HEA, and develop the application of nanotwinned HEA systems.

Recent Advances on High-Entropy Alloys for 3D Printing.

Boosted by the success of high-entropy alloys (HEAs) manufactured by conventional processes in various applications, the development of HEAs for 3D printing has been advancing rapidly in recent years. 3D printing of HEAs gives rise to a great potential for manufacturing geometrically complex HEA products with desirable performances, thereby inspiring their increased appearance in industrial applications. Herein, a comprehensive review of the recent achievements of 3D printing of HEAs is provided, in the aspects of their powder development, printing processes, microstructures, properties, and potential applications. It begins with the introduction of the fundamentals of 3D printing and HEAs, as well as the unique properties of 3D-printed HEA products. The processes for the development of HEA powders, including atomization and mechanical alloying, and the powder properties, are then presented. Thereafter, typical processes for printing HEA products from powders, namely, directed energy deposition, selective laser melting, and electron beam melting, are discussed with regard to the phases, crystal features, mechanical properties, functionalities, and potential applications of these products (particularly in the aerospace, energy, molding, and tooling industries). Finally, perspectives are outlined to provide guidance for future research.

Indentation-induced plastic behaviour of nanotwinned Cu/high entropy alloy FeCoCrNi nanolaminate: an atomic simulation.

Using large-scale molecular dynamics (MD) simulations, the effects of interface and layer number in the nanoindentation response of experimentally observed nanotwinned Cu/high entropy alloy (HEA) FeCoCrNi nanolaminate are studied. The dislocations are nucleated and emitted, which are more limited to the first twinning layer > second twinning layer > HEA layer. The stacking fault strengthening is pronounced due to the obvious difference of stacking fault energy between Cu and HEA, which can be rarely observed from the previous work in traditional alloys and metals. After the indentation induced deformation, the nanotwinned Cu/HEA FeCoCrNi nanolaminates for different layer numbers generate a mass of Shockley partial dislocations to cause the good plasticity, attributed to the strong strain gradient effect. The strong layer number and interface structure effects found here can provide insight for the design of advanced nanolaminate with high strength and good plasticity.

Interface-governed nanometric machining behaviour of Cu/Ag bilayers using molecular dynamics simulation.

The nanometric machining of Cu/Ag bilayers and pure Cu film is performed using molecular dynamics (MD) simulations. The mechanical and tribological properties of Cu/Ag bilayers are investigated by comparing with those of pure Cu film. The effects of machining parameters (indenter radius, tool speed and machining depth) on the subsurface damage and material removal are studied by analyzing the dislocation movement, chipping volume, machining force and average temperature of the workpiece. The results show that the hardness of Cu/Ag bilayers is smaller than that of pure Cu film, due to the dislocation nucleation and emission from the Cu/Ag interface. Meanwhile, the friction coefficient of Cu/Ag bilayers is larger than that of pure Cu film. Furthermore, the metal bonding energy at the Cu/Ag interface is weaker than that in pure Cu film, which causes the low hardness in the Cu/Ag bilayers. The Young's moduli in the Cu/Ag bilayers and pure Cu film are calculated by the Hertz contact mechanism and are close to the experimental result. During nanometric machining of Cu/Ag bilayers, the larger indenter radius or higher tool speed would cause a larger indentation force. The chipping volume, machining force and average temperature would increase with the increment of indenter radius, tool speed and machining depth. The subsurface damage can be reduced by selecting the smaller indenter radius, lower tool speed, and smaller machining depth, where fewer lattice defects are produced. In addition, the selection of lower tool speed also plays a crucial role in improving the smoothness of the ground surface.

Effects of Annealing on Microstructure and Mechanical Properties of Metastable Powder Metallurgy CoCrFeNiMo0.2 High Entropy Alloy.

A CoCrFeNiMo0.2 high entropy alloy (HEA) was prepared through powder metallurgy (P/M) process. The effects of annealing on microstructural evolution and mechanical properties of P/M HEAs were investigated. The results show that the P/M HEA exhibit a metastable FCC single-phase structure. Subsequently, annealing causes precipitation in the grains and at the grain boundaries simultaneously. As the temperature increases, the size of the precipitates grows, while the content of the precipitates tends to increase gradually first, and then decrease as the annealing temperature goes up to 1000 °C. As the annealing time is prolonged, the size and content of the precipitates gradually increases, eventually reaching a saturated stable value. The mechanical properties of the annealed alloys have a significant correspondence with the precipitation behavior. The larger the volume fraction and the size of the precipitates, the higher the strength and the lower the plasticity of the HEA. The CoCrFeNiMo0.2 high entropy alloy, which annealed at 800 °C for 72 h, exhibited the most excellent mechanical properties with the ultimate tensile strength of about 850 MPa and an elongation of about 30%. Nearly all of the annealed HEAs exhibit good strength-ductility combinations due to the significant precipitation enhancement and nanotwinning. The separation of the coarse precipitation phase and the matrix during the deformation process is the main reason for the formation of micropores. Formation of large volume fraction of micropores results in a decrease in the plasticity of the alloy.

Microstructure and Mechanical Properties of Particulate Reinforced NbMoCrTiAl High Entropy Based Composite.

A novel metal matrix composite based on the NbMoCrTiAl high entropy alloy (HEA) was designed by the in-situ formation method. The microstructure, phase evolution, and compression mechanical properties at room temperature of the composite are investigated in detail. The results confirmed that the composite was primarily composed of body-centered cubic solid solution with a small amount of titanium carbides and alumina. With the presence of approximately 7.0 vol. % Al2O3 and 32.2 vol. % TiC reinforced particles, the compressive fracture strength of the composite (1542 MPa) was increased by approximately 50% compared with that of the as-cast NbMoCrTiAl HEA. In consideration of the superior oxidation resistance, the P/M NbMoCrTiAl high entropy alloy composite could be considered as a promising high temperature structural material.

Revealing the deformation mechanism of amorphous polyethylene subjected to cycle loading via molecular dynamics simulations.

Despite tremendous efforts being devoted to the study of the deformation behavior of polyethylene, the deformation mechanism of an amorphous polyethylene polymer under cycle shear-loading remains largely unknown. Here, we report the cycle shear deformation mechanism of an amorphous polyethylene polymer using molecular dynamics (MD) simulations. The stress-strain behaviors, including the elastic, yield, strain hardening, and strain softening regions, are qualitatively in agreement with the previous results. The values of the yield stress, Young's modulus and ultimate strength obtained from MD simulations are consistent with the previous data. The effects of the shear strain rate, temperature, and cycle shear-loading number on the stress-strain behaviors are investigated. Higher strain rate and a lower temperature result in a higher strength in the amorphous polyethylene polymer, attributed to the agglomeration of high local strains. With the increase of the cycle shear-loading number, the high strain region gradually expands from the upper and lower surface to the interior of the polyethylene polymer matrix, which provides the origin of crack initiation. The energy contributions are used in elucidating the inherent deformation mechanisms within the elastic, yielding, strain hardening, and strain softening regions, and the variation trend of energy is consistent with the stress-strain response.