scholarly journals The Influence of Grain Boundaries on Crystal Structure and Tensile Mechanical Properties of Al0.1CoCrFeNi High-Entropy Alloys Studied by Molecular Dynamics Method

Crystals ◽  
2021 ◽  
Vol 12 (1) ◽  
pp. 48
Author(s):  
Cuixia Liu ◽  
Rui Wang ◽  
Zengyun Jian
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Grain Boundary ◽  
Grain Boundaries ◽  
Molecular Dynamics Method ◽  
High Entropy Alloy ◽  
High Entropy Alloys ◽  
Face Centered Cubic ◽  
High Entropy ◽  
Dynamics Method

The mechanical properties of high-entropy alloys are superior to those of traditional alloys. However, the key problem of finding a strengthening mechanism is still challenging. In this work, the molecular dynamics method is used to calculate the tensile properties of face-centered cubic Al0.1CoCrFeNi high-entropy alloys containing Σ3 grain boundaries and without grain boundary. The atomic model was established by the melting rapid cooling method, then stretched by the static drawing method. The common neighbor analysis and dislocation extraction algorithm are used to analyze the crystal evolution mechanism of Σ3 grain boundaries to improve the material properties of high-entropy alloys during the tensile test. The results show that compared with the mechanical properties Al0.1CoCrFeNi high-entropy alloys without grain boundary, the yield strength and Young’s modulus of a high-entropy alloy containing Σ3 grain boundary are obviously larger than that of high-entropy alloys without grain boundary. Dislocation type includes mainly 1/6<112> Shockley partial dislocations, a small account of 1/6<110> Stair-rod, 1/2<110>perfect dislocation, and 1/3<111> Hirth dislocations. The mechanical properties of high-entropy alloys are improved by dislocation entanglement and accumulation near the grain boundary.

Molecular Dynamics Study on the Diffusion Process of AuAgCuNiPd High-entropy Alloy Metallurgy Induced by Pulsed Laser Heating

2021 ◽  
Author(s):  
Gen Lin ◽  
Jianwu Guo ◽  
Pengfei Ji
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Laser Heating ◽  
Pulsed Laser ◽  
High Entropy Alloy ◽  
High Entropy Alloys ◽  
High Entropy ◽  
Alloy Material ◽  
Wide Range ◽  
Pulsed Laser Heating

As a novel alloy material with outstanding mechanical properties, high-entropy alloys have a wide range of promising applications. By establishing individual Au, Ag, Cu, Ni, and Pd nanolaminates with faced-centered-cubic...

Mechanical behaviors of AlCrFeCuNi high-entropy alloys under uniaxial tension via molecular dynamics simulation

RSC Advances ◽  
2016 ◽  
Vol 6 (80) ◽  
pp. 76409-76419 ◽  
Author(s):  
Jia Li ◽  
QiHong Fang ◽  
Bin Liu ◽  
YouWen Liu ◽  
Yong Liu
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Uniaxial Tension ◽  
Deformation Mechanism ◽  
Dynamics Simulation ◽  
High Entropy Alloy ◽  
High Entropy Alloys ◽  
Mechanical Behaviors ◽  
High Entropy

Although a high-entropy alloy has exhibited promising mechanical properties, little attention has been given to the dynamics deformation mechanism during uniaxial tension, which limits its widespread and practical utility.

scholarly journals Nanoporous Quasi-High-Entropy Alloy Microspheres

Metals ◽  
2019 ◽  
Vol 9 (3) ◽  
pp. 345 ◽  
Author(s):  
Lianzan Yang ◽  
Yongyan Li ◽  
Zhifeng Wang ◽  
Weimin Zhao ◽  
Chunling Qin
Keyword(s):  
Mechanical Properties ◽  
Solid Solution ◽  
Specific Surface ◽  
Surface Area ◽  
Specific Surface Area ◽  
High Specific Surface Area ◽  
High Entropy Alloy ◽  
Face Centered Cubic ◽  
High Entropy ◽  
Hierarchical Porous

High-entropy alloys (HEAs) present excellent mechanical properties. However, the exploitation of chemical properties of HEAs is far less than that of mechanical properties, which is mainly limited by the low specific surface area of HEAs synthesized by traditional methods. Thus, it is vital to develop new routes to fabricate HEAs with novel three-dimensional structures and a high specific surface area. Herein, we develop a facile approach to fabricate nanoporous noble metal quasi-HEA microspheres by melt-spinning and dealloying. The as-obtained nanoporous Cu30Au23Pt22Pd25 quasi-HEA microspheres present a hierarchical porous structure with a high specific surface area of 69.5 m2/g and a multiphase approximatively componential solid solution characteristic with a broad single-group face-centered cubic XRD pattern, which is different from the traditional single-phase or two-phase solid solution HEAs. To differentiate, these are named quasi-HEAs. The synthetic strategy proposed in this paper opens the door for the synthesis of porous quasi-HEAs related materials, and is expected to promote further applications of quasi-HEAs in various chemical fields.

scholarly journals Effects of Different Contents of Each Component on the Structural Stability and Mechanical Properties of Co-Cr-Fe-Ni High-Entropy Alloys

2021 ◽  
Vol 11 (6) ◽  
pp. 2832
Author(s):  
Haibo Liu ◽  
Cunlin Xin ◽  
Lei Liu ◽  
Chunqiang Zhuang
Keyword(s):  
Mechanical Properties ◽  
Structural Stability ◽  
High Entropy Alloys ◽  
Face Centered Cubic ◽  
Obvious Effect ◽  
High Entropy ◽  
Precise Control ◽  
Component Content ◽  
Face Centered ◽  
And Performance

The structural stability of high-entropy alloys (HEAs) is closely related to their mechanical properties. The precise control of the component content is a key step toward understanding their structural stability and further determining their mechanical properties. In this study, first-principle calculations were performed to investigate the effects of different contents of each component on the structural stability and mechanical properties of Co-Cr-Fe-Ni HEAs based on the supercell model. Co-Cr-Fe-Ni HEAs were constructed based on a single face-centered cubic (FCC) solid solution. Elemental components have a clear effect on their structure and performance; the Cr and Fe elements have an obvious effect on the structural stability and equilibrium lattice constant, respectively. The Ni elements have an obvious effect on stiffness. The Pugh ratios indicate that Cr and Ni addition may increase ductility, whereas Co and Fe addition may decrease it. With increasing Co and Fe contents or decreasing Cr and Ni contents, the structural stability and stiffness of Co-Cr-Fe-Ni HEAs are improved. The structural stability and mechanical properties may be related to the strength of the metallic bonding and covalent bonding inside Co-Cr-Fe-Ni HEAs, which, in turn, is determined by the change in element content. Our results provide the underlying insights needed to guide the optimization of Co-Cr-Fe-Ni HEAs with excellent mechanical properties.

scholarly journals The Effect of Phase Separation on the Mechanical Behavior of the Co–Cr–Cu–Fe–Ni High-Entropy Alloy

Materials ◽  
2021 ◽  
Vol 14 (21) ◽  
pp. 6523
Author(s):  
Heling Liu ◽  
Chuanxiao Peng ◽  
Xuelian Li ◽  
Shenghai Wang ◽  
Li Wang
Keyword(s):  
Mechanical Properties ◽  
Phase Separation ◽  
Grain Boundaries ◽  
Deformation Behavior ◽  
Grain Boundary Sliding ◽  
Dynamics Simulation ◽  
Uniaxial Tensile ◽  
High Entropy Alloy ◽  
High Entropy ◽  
Critical Resolved Shear Stress

Phase separation phenomena in high-entropy alloys (HEAs) have attracted much attention since their discovery, but little attention has been given to the dynamics of the deformation mechanism of this kind of HEA during uniaxial tension, which limits their widespread and practical utility. In this work, molecular dynamics simulation was used to study the effect of phase separation on the mechanical properties of an HEA under uniaxial tensile loading. Moreover, the associated deformation behavior of the Co–Cr–Cu–Fe–Ni HEA was investigated at the nanoscale. Models with Cu-rich grain boundaries or grains were constructed. The results showed that Cu-rich grain boundaries or grains lowered the strength of the Co–Cr–Cu–Fe–Ni HEA, and Cu-rich grain boundaries significantly reduced ductility. This change of mechanical properties was closely associated with a deformation behavior. Furthermore, the deformation behavior was affected by the critical resolved shear stress of Cu-rich and Cu-depleted regions and the uneven stress distribution caused by phase separation. In addition, dislocation slipping and grain boundary sliding were the main mechanisms of plastic deformation in the Co–Cr–Cu–Fe–Ni HEA.

Effect of Interstitial Elements on the Cryogenic Mechanical Behavior of FCC High Entropy Alloys

2021 ◽  
Vol 1016 ◽  
pp. 1386-1391
Author(s):  
Anastasia Semenyuk ◽  
Margarita Klimova ◽  
Sergey Zherebtsov ◽  
Nikita Stepanov
Keyword(s):  
Mechanical Properties ◽  
Solid Solution ◽  
Thermomechanical Processing ◽  
Induction Melting ◽  
High Entropy Alloys ◽  
Strengthening Effect ◽  
Face Centered Cubic ◽  
High Entropy ◽  
C And N ◽  
Interstitial Elements

High entropy alloys (HEAs) with face-centered cubic (fcc) structure, namely equiatomic CoCrFeMnNi alloy, have attracted considerable attention because of impressive cryogenic mechanical properties – strength, ductility, and fracture toughness. Further increase of the properties can be achieved, for example, by proper alloying. A particularly attractive option is the addition of interstitial elements like carbon or nitrogen. In present work, a series of CoCrFeMnNi-based alloys with different amounts of C and N (0-2 at.%) was prepared by induction melting. The alloys doped with C had lower Cr content to increase the solubility of carbon in the fcc solid solution. It was revealed that the solid solution strengthening effect of both C and N is significantly increased when the testing temperature decreases from 293K to 77K. The effect of thermomechanical processing on the structure and mechanical properties of the alloys is analyzed.

scholarly journals Dynamic Mechanical Properties and Microstructure of an (Al0.5CoCrFeNi)0.95Mo0.025C0.025 High Entropy Alloy

Entropy ◽  
2019 ◽  
Vol 21 (12) ◽  
pp. 1154
Author(s):  
Bingfeng Wang ◽  
Chu Wang ◽  
Bin Liu ◽  
Xiaoyong Zhang
Keyword(s):  
Mechanical Properties ◽  
Shear Band ◽  
High Strain Rate ◽  
Strain Rate ◽  
High Strain ◽  
Dynamic Mechanical Properties ◽  
High Entropy Alloy ◽  
Face Centered Cubic ◽  
High Entropy ◽  
Dynamic Mechanical

The dynamic mechanical properties and microstructure of the (Al0.5CoCrFeNi)0.95Mo0.025C0.025 high entropy alloy (HEA) prepared by powder extrusion were investigated by a split Hopkinson pressure bar and electron probe microanalyzer and scanning electron microscope. The (Al0.5CoCrFeNi)0.95Mo0.025C0.025 HEA has a uniform face-centered cubic plus body-centered cubic solid solution structure and a fine grain-sized microstructure with a size of about 2 microns. The HEA possesses an excellent strain hardening rate and high strain rate sensitivity at a high strain rate. The Johnson–Cook plastic model was used to describe the dynamic flow behavior. Hat-shaped specimens with different nominal strain levels were used to investigate forced shear localization. After dynamic deformation, a thin and short shear band was generated in the designed shear zone and then the specimen quickly fractured along the shear band.

scholarly journals Effect of Mo Addition on The Microstructure and Mechanical Properties of CoCuFeNi High Entropy Alloy

Metals ◽  
2020 ◽  
Vol 10 (8) ◽  
pp. 1017
Author(s):  
Yang Shao ◽  
Huan Ma ◽  
Yibing Wang
Keyword(s):  
Mechanical Properties ◽  
Solution Structure ◽  
Tensile Tests ◽  
Atomic Ratio ◽  
Vacuum Arc ◽  
High Entropy Alloy ◽  
High Entropy Alloys ◽  
High Entropy ◽  
Microstructure And Mechanical Properties ◽  
Mo Content

In order to reveal the effect of Mo addition on the microstructure and mechanical properties, (CoCuFeNi)100-xMox (x = 0, 10, 15, 19, and 25, x values in atomic ratio) high entropy alloys were prepared by vacuum arc-melting. The results showed that with Mo addition, the μ phase formed and serious separation occurred in the high entropy alloys. The content of μ phase increased with the increase in Mo content. The microstructure of the alloys changed from an initial single-phase face-center-cubic (FCC) solid solution structure (x = 0) to a hypoeutectic microstructure (x = 15), then to a full eutectic microstructure (x = 19), and finally to a hypereutectic microstructure (x = 25). Coherent interface between μ phase and FCC phase was observed. The (CoCuFeNi)81Mo19 alloy with fully eutectic microstructures exhibited the highest yield strength of 557 MPa and fracture strength of 767 MPa in tensile tests at room temperature. The fracture surface revealed that the formation of great amounts of the μ phase resulted in the loss of ductility of (CoCuFeNi)100-xMox alloys.

Sign in / Sign up

Export Citation Format

Share Document