A High Throughput CALPHAD Approach to Design B2 + bcc Microstructures Using Spinodal-Assisted Transformation Pathways and Experimental Validation: Al10Mo10Nb10Ta10Ti30Zr30

Abstract In this work, we implement high throughput CALPHAD calculations to systematically scan the Al–Mo–Nb–Ta–Ti–Zr elemental space and design HEA compositions which exhibit only nanoscale B2 + bcc microstructures. From this down-selection, experimental observations of a particular alloy composition are reported. Specific heat treatment strategies were employed to probe the accuracy of thermodynamic predictions and to investigate the nature of the decomposition products. Solutionizing followed by water quenching indicates that phase separation cannot be suppressed. Solutionizing followed by a step-quench to, and aging treatment at, 750 °C produces a three-phase microstructure consisting of a matrix phase with the B2 structure. The nanoscale, disordered bcc precipitates have a uniform spatial distribution, suggesting a spinodal-assisted phase transformation pathway. An Al–Zr rich phase, with an hexagonal structure, is present with low phase fractions.

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Publication Details

Journal
Metallography Microstructure and Analysis
Published
2026-09-25
DOI
https://doi.org/10.1007/s13632-026-01400-9
Primary Topic
Intermetallics and Advanced Alloy Properties
Type
article
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A High Throughput CALPHAD Approach to Design B2 + bcc Microstructures Using Spinodal-Assisted Transformation Pathways and Experimental Validation: Al10Mo10Nb10Ta10Ti30Zr30

Shalini Roy Koneru, Gopal Viswanathan, Shiddhartha Ramprakash, Brian Welk et al.
Metallography Microstructure and Analysis
Intermetallics and Advanced Alloy Properties
article

A High Throughput CALPHAD Approach to Design B2 + bcc Microstructures Using Spinodal-Assisted Transformation Pathways and Experimental Validation: Al10Mo10Nb10Ta10Ti30Zr30

Shalini Roy Koneru, Gopal Viswanathan, Shiddhartha Ramprakash, Brian Welk, Hamish Fraser, Paraic O’Kelly, Yunzhi Wang
article en

Abstract

Abstract In this work, we implement high throughput CALPHAD calculations to systematically scan the Al–Mo–Nb–Ta–Ti–Zr elemental space and design HEA compositions which exhibit only nanoscale B2 + bcc microstructures. From this down-selection, experimental observations of a particular alloy composition are reported. Specific heat treatment strategies were employed to probe the accuracy of thermodynamic predictions and to investigate the nature of the decomposition products. Solutionizing followed by water quenching indicates that phase separation cannot be suppressed. Solutionizing followed by a step-quench to, and aging treatment at, 750 °C produces a three-phase microstructure consisting of a matrix phase with the B2 structure. The nanoscale, disordered bcc precipitates have a uniform spatial distribution, suggesting a spinodal-assisted phase transformation pathway. An Al–Zr rich phase, with an hexagonal structure, is present with low phase fractions.

Metallography Microstructure and Analysis
Clean water and sanitation
Openalex Percentile: Top 21%
Intermetallics and Advanced Alloy Properties
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A High Throughput CALPHAD Approach to Design B2 + bcc Microstructures Using Spinodal-Assisted Transformation Pathways and Experimental Validation: Al10Mo10Nb10Ta10Ti30Zr30 — Shalini Roy Koneru, Gopal Viswanathan, et al. · Metallography Microstructure and Analysis (2026) | TGRS Research Map | TGRS