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Meeting 2021 TMS Annual Meeting & Exhibition
Symposium AI/Data informatics: Tools for Accelerated Design of High-temperature Alloys
Presentation Title Coupling of Data Mining, Thermodynamics and Multi-objective Genetic Algorithms for the Design of High-temperature Alloys
Author(s) Franck Tancret, Edern Menou, Gérard Ramstein
On-Site Speaker (Planned) Franck Tancret
Abstract Scope Our use of artificial intelligence (AI) to design high-temperature alloys (HTA) started more than twenty years ago with the modelling of mechanical properties of nickel-based superalloys as a function of composition, using data mining tools like artificial neural networks and Gaussian processes (GP). Such machine learning (ML) models were then associated to the calculation of phase diagrams (Calphad / Thermo-Calc) to design an affordable wrought superalloy for power plant applications, and later a set of single-crystal superalloys for aeroengines. Other AI tools, like genetic algorithms (GA), including their multi-objective optimisation (MOO) version, were then coupled to both ML and Calphad to propose the most advanced integrated computational alloy design scheme at its time, along with the successful redesign of a proprietary superalloy for turbine disks. Current works are ongoing, both on algorithm development and on the design of HTAs like so-called high entropy alloys (HEA) or complex concentrated alloys (CCA).
Proceedings Inclusion? Planned:

OTHER PAPERS PLANNED FOR THIS SYMPOSIUM

Advanced Data SCiENce Toolkit for Non-data Scientists (ASCENDS) - A Case Study of the Oxidation Kinetics of NiCr-based Alloys
Coupling of Data Mining, Thermodynamics and Multi-objective Genetic Algorithms for the Design of High-temperature Alloys
Determining Solute Site Preference and Correlations to Antiphase Boundary Energy in Ni-based Superalloys
Domain and Uncertainty Quantification in Machine Learning Models of Alloy Properties
Domain Knowledge-informed, Process-mapping AI Graph for Designing Fe-based Alloys
Elastic Properties Machine-learning-based Descriptor for a Refractory High Entropy Alloy
Expanding Materials Selection via Transfer Learning for High-temperature Oxide Selection
Exploring the Compositional Space of High Entropy Alloys via Sequential Learning
Knowledge-driven Platform for Federated Multimodal Big Data Storage & Analytics
Machine Learning Augmented Predictive & Generative Models for Rupture Life in High Temperature Alloys
Optimal Design of High-temperature, Oxidation-resistant Complex Concentrated Alloys
Predicting Vibrational Entropy of FCC Solids Uniquely from Bond Chemistry Using Machine Learning
Predicting Yield Stress of High Temperature Alloys via Computer Vision and Machine Learning
Revealing Nanoscale Features Controlling Diffusion Within Multi-component Alloys through Machine Learning
Toward High Throughput Design and Development of Multi-principal Element Alloys for Corrosion and Oxidation Resistance (MPEAs)
Uncertainty Quantification for Thermo-mechanical Behavior of Aircraft Engine Materials in Elevated Temperatures
Uncertainty Reduction for Calculated Phase Equilibria

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