Design Guidelines for High Strength Multicomponent Alloys

高强度多组分合金设计指南

基本信息

项目摘要

A new class of alloys called "High Entropy Alloys" is emerging as candidate materials for high strength applications. These alloys have very complex chemistries and are composed of a large number of elements. The processes by which they deform are also complex. This award supports research to understand deformation and fracture behavior of these alloys. The researchers seek to understand how the complex composition of these materials can be used to advantage the search of high strength and ductile alloys. By varying different compositional and processing parameters, it is expected that useful criteria may be found to optimize the combination of strength and ductility. The research will be incorporated in curriculum development for the education of future generations of researchers that are trained to use these computational tools in combination with experiments. The project contributes to the education of high school and undergraduate students through web educational modules used in undergraduate and graduate courses, summer camps, and internships. These instructional materials are geared particularly for female students to encourage their participation in this field. This research effort is based on the hypothesis that by varying atomic interaction parameters, useful criteria can be found to optimize the combination of strength and ductility. Because of limitations in the number of atoms that can be studied using first principle calculations, the researchers will utilize simple model interaction potentials for various degrees of variation in atomic sizes, cohesive energies, and chemical interaction. They will obtain trends in strength and fracture toughness as a function of these varying degrees of complexity. These trends will be compared with available experimental studies of the mechanical behavior of various high entropy alloys that indicate increased ductility while maintaining high strength. The methodology developed here for model interactions provides a basis for future computational modeling. Most importantly, the insight provided by this work enable more efficient design of single-phase high entropy alloys for a variety of applications.
一种称为“高熵合金”的新型合金正在成为高强度应用的候选材料。这些合金具有非常复杂的化学性质,由大量元素组成。它们变形的过程也很复杂。该奖项支持了解这些合金的变形和断裂行为的研究。 研究人员试图了解如何利用这些材料的复杂成分来促进高强度和韧性合金的研究。通过改变不同的组成和工艺参数,可以预期可以找到有用的标准来优化强度和延展性的组合。这项研究将被纳入课程开发,以教育未来几代研究人员,这些研究人员将接受培训,以使用这些计算工具与实验相结合。该项目通过在本科生和研究生课程、夏令营和实习中使用的网络教育模块,为高中生和本科生的教育做出贡献。这些教材特别针对女生,以鼓励她们参与这一领域的活动。 这项研究工作是基于这样的假设,即通过改变原子相互作用参数,可以找到有用的标准来优化强度和延性的组合。由于使用第一原理计算可以研究的原子数量的限制,研究人员将利用简单模型相互作用势来研究原子大小,内聚能和化学相互作用的各种程度的变化。 他们将获得强度和断裂韧性的趋势作为这些不同程度的复杂性的函数。 这些趋势将与各种高熵合金的机械行为的实验研究进行比较,这些研究表明在保持高强度的同时增加了延展性。 这里开发的模型交互方法为未来的计算建模提供了基础。 最重要的是,这项工作提供的见解使单相高熵合金的各种应用更有效的设计。

项目成果

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Diana Farkas其他文献

Nanoporous metals under extremes
  • DOI:
    10.1557/s43577-025-00885-z
  • 发表时间:
    2025-04-02
  • 期刊:
  • 影响因子:
    4.900
  • 作者:
    Carlos J. Ruestes;Diana Farkas;Joshua Snyder
  • 通讯作者:
    Joshua Snyder
Planar fault energies and dislocation core spreading in B2 NiAl
  • DOI:
    10.1557/jmr.1993.3050
  • 发表时间:
    2011-03-03
  • 期刊:
  • 影响因子:
    2.900
  • 作者:
    Diana Farkas;Christophe Vailhe
  • 通讯作者:
    Christophe Vailhe
High-Throughput Machine Learning - Kinetic Monte Carlo Framework for Diffusion Studies in Equiatomic and Non-equiatomic FeNiCrCoCu High-Entropy Alloys
高通量机器学习 - 用于等原子和非等原子 FeNiCrCoCu 高熵合金扩散研究的动力学蒙特卡罗框架
  • DOI:
  • 发表时间:
    2023
  • 期刊:
  • 影响因子:
    3.4
  • 作者:
    Wenjiang Huang;Diana Farkas;Xian
  • 通讯作者:
    Xian
Determination of grain boundary geometry using TEM
使用 TEM 确定晶界几何形状
  • DOI:
    10.1557/jmr.1992.1707
  • 发表时间:
    1992
  • 期刊:
  • 影响因子:
    2.7
  • 作者:
    H. Jang;Diana Farkas;J. Hosson
  • 通讯作者:
    J. Hosson
The role of compositional complexity in the increased fracture resistance of high entropy alloys: Multi-scale atomistic simulations
  • DOI:
    10.1016/j.commatsci.2023.112758
  • 发表时间:
    2024-02
  • 期刊:
  • 影响因子:
    3.3
  • 作者:
    Diana Farkas
  • 通讯作者:
    Diana Farkas

Diana Farkas的其他文献

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{{ truncateString('Diana Farkas', 18)}}的其他基金

DMREF/Collaborative Research: Designing and Synthesizing Nano-Metallic Materials with Superior Properties
DMREF/合作研究:设计和合成具有优越性能的纳米金属材料
  • 批准号:
    1533969
  • 财政年份:
    2016
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Standard Grant
Symposium: Massively Parallel Simulations of Materials Response
研讨会:材料响应的大规模并行模拟
  • 批准号:
    1047848
  • 财政年份:
    2010
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Standard Grant
NSF-Europe: Computer Simulation of Fracture and Deformation Behavior of Nanocrystalline Metallic Materials
NSF-欧洲:纳米晶金属材料断裂和变形行为的计算机模拟
  • 批准号:
    0243947
  • 财政年份:
    2003
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Continuing Grant
Atomistic Theory and Computer Simulation of Grain Boundary Structure and Diffusion
晶界结构和扩散的原子理论和计算机模拟
  • 批准号:
    9753243
  • 财政年份:
    1998
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Continuing Grant
U.S.-Argentina Cooperative Research: Atomistic Simulation of Defect Structures in Intermetallic Alloys
美国-阿根廷合作研究:金属间合金缺陷结构的原子模拟
  • 批准号:
    9512968
  • 财政年份:
    1996
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Standard Grant
U.S.-Argentina Cooperative Science Program: Computer Simulation of Defect Structure in Intermetallic Alloys
美国-阿根廷合作科学项目:金属间合金缺陷结构的计算机模拟
  • 批准号:
    9201759
  • 财政年份:
    1992
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Standard Grant
Faculty Awards for Women Scientists and Engineers
女科学家和工程师学院奖
  • 批准号:
    9024161
  • 财政年份:
    1991
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Continuing Grant
U.S.-Argentina Cooperative Research: Theoretical Models forRadiation-Enhanced Diffusion During Ion Implantation
美国-阿根廷合作研究:离子注入过程中辐射增强扩散的理论模型
  • 批准号:
    8815682
  • 财政年份:
    1989
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Standard Grant
U.S.-Argentina Cooperative Research: Theoretical Models for Radiation-Enhanced Diffusion (Condensed Matter Theory)
美国-阿根廷合作研究:辐射增强扩散的理论模型(凝聚态理论)
  • 批准号:
    8502374
  • 财政年份:
    1985
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Standard Grant
Theoretical Models For Radiation-Enhanced Diffusion
辐射增强扩散的理论模型
  • 批准号:
    8412040
  • 财政年份:
    1984
  • 资助金额:
    $ 30.75万
  • 项目类别:
    Standard Grant

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