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Keywords = Thermo-Calc

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16 pages, 4973 KB  
Article
Microstructure Evolution of a TRIP Fe–1.4Si–2.6Mn–0.17C Steel After Intercritical Treating and Its Effect on Mechanical Properties
by Valeria Miranda-Lopez, Manuel Alejandro Beltrán-Zúñiga, Victor M. Lopez-Hirata, Hector J. Dorantes-Rosales and Maribel L. Saucedo-Muñoz
Metals 2025, 15(10), 1096; https://doi.org/10.3390/met15101096 - 1 Oct 2025
Viewed by 262
Abstract
This work studied microstructure evolution during the intercritical treatment of Fe–1.4Si–2.6Mn–0.17C TRIP steel. Steel specimens were heated in the intercritical region, α ferrite and γ austenite phases, at 750 °C for 30 min, water-quenched, air-cooled, and austempered at 350 °C for 30 min. [...] Read more.
This work studied microstructure evolution during the intercritical treatment of Fe–1.4Si–2.6Mn–0.17C TRIP steel. Steel specimens were heated in the intercritical region, α ferrite and γ austenite phases, at 750 °C for 30 min, water-quenched, air-cooled, and austempered at 350 °C for 30 min. Microstructural analysis was performed by optical microscopy, scanning electron microscopy, and X-ray diffraction. All heat-treated specimens were mechanically characterized by uniaxial tension and Vickers hardness tests. Thermo-Calc software 2024b was used to analyze the microstructure and phases of heat-treated steel. The microstructural characterization results revealed that the phases and microconstituents were ferrite, austenite, cementite, pearlite, and retained austenite. Thermo-Calc results were consistent with the phases and microconstituents identified for each heat-treatment condition. On the other hand, the tension test results showed that the yield strength and ultimate tensile strength ranged between 690 and 820 MPa and 1190–1255 MPa, respectively, for these heat-treated steels. Likewise, Thermo-Calc proved to be a powerful tool for designing intercritical heat treatments for TRIP steels. Full article
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12 pages, 479 KB  
Article
Quantifying Latent Heat in AlSi5Cu Alloys (with 1, 2, and 4% of Cu by Mass) via DSC, Thermal Analysis, and Commercial Software
by Mile Djurdjevic, Vladimir Jovanovic and Srecko Stopic
Metals 2025, 15(9), 1045; https://doi.org/10.3390/met15091045 - 19 Sep 2025
Viewed by 234
Abstract
This study comprehensively evaluates the latent heat of hypoeutectic AlSi5Cu alloys with 1, 2, and 4% of Cu by mass, investigating their solidification behavior under controlled cooling conditions. Latent heat, a critical thermophysical property, significantly influences solidification and microstructural formation in casting processes. [...] Read more.
This study comprehensively evaluates the latent heat of hypoeutectic AlSi5Cu alloys with 1, 2, and 4% of Cu by mass, investigating their solidification behavior under controlled cooling conditions. Latent heat, a critical thermophysical property, significantly influences solidification and microstructural formation in casting processes. The evaluation employed an integrated approach, combining experimental measurements from Differential Scanning Calorimetry (DSC) and thermal analysis (TA-Newtonian method) with computational assessments performed using JMatPro and Thermo-Calc software packages. The findings reveal a reasonable agreement between the measured and calculated latent heat values, suggesting that methods beyond DSC, such as commercial software and thermal analysis techniques, offer acceptable and viable alternatives for determining latent heat in AlSiCu alloys. While DSC served as the experimental reference, providing particularly consistent lowest values for AlSi5Cu1 and AlSi5Cu2, relative error analysis indicated that JMatPro generally yielded results closest to DSC, especially for AlSi5Cu2 (0.245% relative error), and the TA-Newtonian method also showed strong agreement, particularly for AlSi5Cu1 (0.356% relative error) and AlSi5Cu4 (0.787% relative error). Maximum deviation was observed with Thermo-Calc for AlSi5Cu1 (7.474%). These discrepancies are primarily attributed to inherent differences in the underlying thermodynamic databases for computational tools and the sensitivity of experimental techniques to specific material properties and solidification behaviors. Full article
(This article belongs to the Special Issue Solidification and Casting of Metals and Alloys (2nd Edition))
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17 pages, 7205 KB  
Article
Evolution of Microstructure and the Influence of Carbides on Hardness Properties in Martensitic Stainless Steel 90Cr18MoV During Heat Treatment
by Shengfu Yuan, Ruizhi Wang, Xuelin Wang, Fajian Jiang, Chengjia Shang and Xinghua Wu
Metals 2025, 15(9), 999; https://doi.org/10.3390/met15090999 - 9 Sep 2025
Viewed by 632
Abstract
In this study, we utilized Thermo-Calc software (2023a) to optimize the heat treatment process of martensitic stainless steel 90Cr18MoV through phase diagram calculations. The microhardness of 90Cr18MoV was characterized using a nanoindentation instrument. The microstructural morphology of the samples was analyzed using scanning [...] Read more.
In this study, we utilized Thermo-Calc software (2023a) to optimize the heat treatment process of martensitic stainless steel 90Cr18MoV through phase diagram calculations. The microhardness of 90Cr18MoV was characterized using a nanoindentation instrument. The microstructural morphology of the samples was analyzed using scanning electron microscopy (SEM). The composition of the samples was characterized through scanning electron backscatter diffraction (EBSD) and X-ray diffraction (XRD). Additionally, laser confocal microscopy (FIB) and transmission electron microscopy (TEM) were employed to characterize the precipitate phase composition and size before and after heat treatment, while also observing the dislocation structure within the samples. The relationship between the quenching temperature and the percentage of residual austenite content in the material was established. The influence of the dislocation structure and precipitate size on the hardness of the samples was investigated. The research findings confirm that the observed secondary hardening phenomenon in tempered samples is attributed to the co-precipitation of two types of carbides, M23C6 and MC, within the matrix. The study investigated the effects of the tempering temperature and duration on the size of secondary precipitates, indicating that M23C6 and MC particles with sizes less than or equal to 20 nm contribute to enhancing the matrix, while particles larger than 30 nm lead to a reduction in hardness after tempering. Notably, during the tempering process, M23C6 precipitated from the matrix nucleates on MC. Full article
(This article belongs to the Special Issue Design, Preparation and Properties of High Performance Steels)
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16 pages, 8293 KB  
Article
Thermodynamic Modeling of Microstructural Design of Lightweight Ferritic Steels
by Tamiru Hailu Kori, Adam Skowronek, Jarosław Opara, Ana Paula Domingos Cardoso and Adam Grajcar
Metals 2025, 15(8), 912; https://doi.org/10.3390/met15080912 - 16 Aug 2025
Viewed by 637
Abstract
Ferritic lightweight steels are an emerging class of low-density steels (LDSs) with promising mechanical properties. The study aimed to develop two ferritic lightweight steels with different Mn concentrations. Al was incorporated to achieve the lightweighting effect due to its relatively low atomic mass [...] Read more.
Ferritic lightweight steels are an emerging class of low-density steels (LDSs) with promising mechanical properties. The study aimed to develop two ferritic lightweight steels with different Mn concentrations. Al was incorporated to achieve the lightweighting effect due to its relatively low atomic mass of substitutional solutions. The C concentration was kept at a minimum level to avoid the precipitation of carbides and the Mn addition was intended to increase solid solution strengthening. Thermodynamic calculations (Thermo-Calc) were employed to design the composition, analyze the phase constituents, and predict the phase transformation behavior. Microstructural investigation and hardness tests were conducted to experimentally verify the calculations. Both produced alloys exhibited a fully ferritic microstructure. Compared to industrially produced DP980 steel, a density reduction of about 7.2% and 8.3% was attained for the Fe-0.04C-5.5Al-1.6Mn-0.075Nb and Fe-0.04C-5.6Al-5.5Mn-0.08Nb steels, respectively. The steel with the higher Mn content showed increased hardness attributed to its solution strengthening effect. An increase in the hardness values was also measured with the progress in hot-rolling thickness reductions for both alloys. The alloying elements influenced the microstructural characteristics, phase transformation behavior, density, and hardness of the newly designed lightweight steels. Full article
(This article belongs to the Special Issue Thermodynamic Modeling of Phase Equilibrium in Metallic Materials)
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17 pages, 6198 KB  
Article
The Influence of Heat Treatment Process on the Residual Ferrite in 304L Austenitic Stainless Steel Continuous Casting Slab
by Zhixuan Xue, Kun Yang, Yafeng Li, Chaochao Pei, Dongzhi Hou, Qi Zhao, Yang Wang, Lei Chen, Chao Chen and Wangzhong Mu
Materials 2025, 18(16), 3724; https://doi.org/10.3390/ma18163724 - 8 Aug 2025
Viewed by 456
Abstract
This study investigates the distribution characteristics of residual ferrite in 304L austenitic stainless steel continuous casting slab and the impact of heat treatment processes on its content. Through optical microscopy (OM), thermodynamic calculation software (Thermo–Calc) and heat treatment experiments, it is found that [...] Read more.
This study investigates the distribution characteristics of residual ferrite in 304L austenitic stainless steel continuous casting slab and the impact of heat treatment processes on its content. Through optical microscopy (OM), thermodynamic calculation software (Thermo–Calc) and heat treatment experiments, it is found that the residual ferrite content along the thickness direction at the width center of the slab exhibits an “M”-shaped distribution—lowest at the edges (approximately 3%) and highest near the center (approximately 13%). Within the triangular zone of the slab, the residual ferrite content varies between 1.8% and 12.2%, with its average along the thickness direction also showing an “M”-shaped distribution; along the width direction, the average residual ferrite content is lower at the edge positions, while within the internal triangular zone, it ranges between 8% and 10%. The ferrite morphology changes significantly across solidification zones: elongated in the surface fine-grain zone, lath-like and skeletal in the columnar grain zone and network-like in the central equiaxed grain zone. Thermodynamic calculations indicate that the solidification mode of the 304L continuous casting slab follows the FA mode. Heat treatment experiments conducted across the entire slab thickness demonstrate effective reduction in residual ferrite content; the optimal reduction is achieved at 1250 °C with a 48 min hold followed by air cooling while preserving the original “M”-shaped distribution characteristic after treatment. Increasing the heat treatment temperature, prolonging the holding time and reducing the cooling rate all contribute to reducing residual ferrite content. Full article
(This article belongs to the Special Issue Advanced Stainless Steel—from Making, Shaping, Treating to Products)
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20 pages, 5638 KB  
Article
Influence of Heat Treatment on Precipitate and Microstructure of 38CrMoAl Steel
by Guofang Xu, Shiheng Liang, Bo Chen, Jiangtao Chen, Yabing Zhang, Xiaotan Zuo, Zihan Li, Bo Song and Wei Liu
Materials 2025, 18(15), 3703; https://doi.org/10.3390/ma18153703 - 6 Aug 2025
Viewed by 551
Abstract
To address the central cracking problem in continuous casting slabs of 38CrMoAl steel, high-temperature tensile tests were performed using a Gleeble-3800 thermal simulator to characterize the hot ductility of the steel within the temperature range of 600–1200 °C. The phase transformation behavior was [...] Read more.
To address the central cracking problem in continuous casting slabs of 38CrMoAl steel, high-temperature tensile tests were performed using a Gleeble-3800 thermal simulator to characterize the hot ductility of the steel within the temperature range of 600–1200 °C. The phase transformation behavior was computationally analyzed via the Thermo-Calc software, while the microstructure, fracture morphology, and precipitate characteristics were systematically investigated using a metallographic microscope (MM), a field-emission scanning electron microscope (FE-SEM), and transmission electron microscopy (TEM). Additionally, the effects of different holding times and cooling rates on the microstructure and precipitates of 38CrMoAl steel were also studied. The results show that the third brittle temperature region of 38CrMoAl steel is 645–1009 °C, and the fracture mechanisms can be classified into three types: (I) in the α single-phase region, the thickness of intergranular proeutectoid ferrite increases with rising temperature, leading to reduced hot ductility; (II) in the γ single-phase region, the average size of precipitates increases while the number density decreases with increasing temperature, thereby improving hot ductility; and (III) in the α + γ two-phase region, the precipitation of proeutectoid ferrite promotes crack propagation and the dense distribution of precipitates at grain boundaries causes stress concentration, further deteriorating hot ductility. Heat treatment experiments indicate that the microstructures of the specimen transformed under water cooling, air cooling, and furnace cooling conditions as follows: martensite + proeutectoid ferrite → bainite + ferrite → ferrite. The average size of precipitates first decreased, then increased, and finally decreased again with increasing holding time, while the number density exhibited the opposite trend. Therefore, when the holding time was the same, reducing the cooling rate could increase the average size of the precipitates and decrease their number density, thereby improving the hot ductility of 38CrMoAl steel. Full article
(This article belongs to the Special Issue Microstructure Engineering of Metals and Alloys, 3rd Edition)
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29 pages, 14647 KB  
Article
Precipitation Processes in Sanicro 25 Steel at 700–900 °C: Experimental Study and Digital Twin Simulation
by Grzegorz Cempura and Adam Kruk
Materials 2025, 18(15), 3594; https://doi.org/10.3390/ma18153594 - 31 Jul 2025
Viewed by 563
Abstract
Sanicro 25 (X7NiCrWCuCoNb25-23-3-3-2) steel is specifically designed for use in superheater components within the latest generation of conventional power plants. These power plants operate under conditions often referred to as super-ultra-supercritical, with steam parameters that can reach up to 30 MPa and temperatures [...] Read more.
Sanicro 25 (X7NiCrWCuCoNb25-23-3-3-2) steel is specifically designed for use in superheater components within the latest generation of conventional power plants. These power plants operate under conditions often referred to as super-ultra-supercritical, with steam parameters that can reach up to 30 MPa and temperatures of 653 °C for fresh steam and 672 °C for reheated steam. While last-generation supercritical power plants still rely on fossil fuels, they represent a significant step forward in more sustainable energy production. The most sophisticated facilities of this kind can achieve thermodynamic efficiencies exceeding 47%. This study aimed to conduct a detailed analysis of the initial precipitation processes occurring in Sanicro 25 steel within the temperature range of 700–900 °C. The temperature of 700 °C corresponds to the operational conditions of this material, particularly in secondary steam superheaters in thermal power plants that operate under ultra-supercritical parameters. Understanding precipitation processes is crucial for optimizing mechanical performance, particularly in terms of long-term strength and creep resistance. To accurately assess the microstructural changes that occur during the early stages of service, a digital twin approach was employed, which included CALPHAD simulations and experimental heat treatments. Experimental annealing tests were conducted in air within the temperature range of 700–900 °C. Precipitation behavior was simulated using the Thermo-Calc 2025a with Dictra software package. The results from Prisma simulations correlated well with the experimental data related to the kinetics of phase transformations; however, it was noted that the predicted sizes of the precipitates were generally smaller than those observed in experiments. Additionally, computational limitations were encountered during some simulations due to the complexity arising from the numerous alloying elements present in Sanicro 25 steel. The microstructural evolution was investigated using various methods, including light microscopy (LM), scanning electron microscopy (SEM), and transmission electron microscopy (TEM). Full article
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15 pages, 4359 KB  
Article
Phase Transformations During Heat Treatment of a CPM AISI M4 Steel
by Maribel L. Saucedo-Muñoz, Valeria Miranda-Lopez, Felipe Hernandez-Santiago, Carlos Ferreira-Palma and Victor M. Lopez-Hirata
Metals 2025, 15(7), 818; https://doi.org/10.3390/met15070818 - 21 Jul 2025
Viewed by 473
Abstract
The phase transformations of Crucible Particle Metallurgy (CPM) American Iron and Steel Institute (AISI) M4 steel were studied during heat treatments using a CALPHAD-based method. The calculated results were compared with experimental observations. The optimum austenitizing temperature was determined to be about 1120 [...] Read more.
The phase transformations of Crucible Particle Metallurgy (CPM) American Iron and Steel Institute (AISI) M4 steel were studied during heat treatments using a CALPHAD-based method. The calculated results were compared with experimental observations. The optimum austenitizing temperature was determined to be about 1120 °C using Thermo-Calc software (2024b). Air-cooling and quenching treatments led to the formation of martensite with a hardness of 63–65 Rockwell C (HRC). The annealing treatment promoted the formation of the equilibrium ferrite and carbide phases and resulted in a hardness of 24 HRC. These findings with regard to phases and microconstituents are in agreement with the predictions derived from a Thermo-Calc-calculated time–temperature–transformation diagram at 1120 °C. Additionally, the primary carbides, MC and M6C, which formed prior to the heat treatment and had a minor influence on the quenched hardness. In contrast, the tempering process primarily led to the formation of fine secondary M6C carbides, which hardened the tempered martensite to 57 HRC. The present work demonstrates the application of a CALPHAD-based methodology to the design and microstructural analysis of tool steels. Full article
(This article belongs to the Special Issue Advances in Steels: Heat Treatment, Microstructure and Properties)
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14 pages, 3909 KB  
Article
Demonstrating In Situ Formation of Globular Microstructure for Thixotropic Printing of EN AW-4043 Aluminum Alloy
by Silvia Marola and Maurizio Vedani
Metals 2025, 15(7), 804; https://doi.org/10.3390/met15070804 - 17 Jul 2025
Viewed by 677
Abstract
This study explores the feasibility of generating a globular microstructure in situ during the thixotropic 3D printing of the EN AW-4043 alloy, starting from a conventional cold-rolled wire. Thermodynamic simulations using Thermo-Calc software were first conducted to identify the semi-solid processing window of [...] Read more.
This study explores the feasibility of generating a globular microstructure in situ during the thixotropic 3D printing of the EN AW-4043 alloy, starting from a conventional cold-rolled wire. Thermodynamic simulations using Thermo-Calc software were first conducted to identify the semi-solid processing window of the alloy, based on the evolution of liquid and solid fractions as a function of temperature. Guided by these results, thermal treatments were performed on cold-rolled wires to promote the formation of a globular microstructure. A laboratory-scale printing head prototype was then designed and built to test continuous heating and deposition conditions representative of a thixotropic additive manufacturing process. The results showed that a globular microstructure could be achieved in the cold-rolled EN AW-4043 wires by heating them at 590 °C for 5 min in a static muffle furnace. A similar effect was observed when continuously heating the wire while it flowed through the heated printing head. Preliminary deposition tests confirmed the viability of this approach and demonstrated that thixotropic 3D printing of EN AW-4043 alloy is achievable without the need for pre-globular feedstock. Full article
(This article belongs to the Section Additive Manufacturing)
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13 pages, 11057 KB  
Article
Microstructure, Hardness and Tribological Characteristics of High-Entropy Coating Obtained by Detonation Spraying
by Zhuldyz Sagdoldina, Laila Sulyubayeva, Dastan Buitkenov and Yedilzhan Kambarov
Crystals 2025, 15(7), 625; https://doi.org/10.3390/cryst15070625 - 4 Jul 2025
Viewed by 431
Abstract
In this study, powders based on a high-entropy AlCoCrFeNi alloy obtained by mechanical alloying were successfully applied to a 316L stainless steel substrate by detonation spraying under various conditions. Their microstructural features, phase composition, hardness, and wear resistance were studied. A comparative analysis [...] Read more.
In this study, powders based on a high-entropy AlCoCrFeNi alloy obtained by mechanical alloying were successfully applied to a 316L stainless steel substrate by detonation spraying under various conditions. Their microstructural features, phase composition, hardness, and wear resistance were studied. A comparative analysis between the initial powder and the coatings was performed, including phase transformation modeling using Thermo-Calc under non-equilibrium conditions. The results showed that the phase composition of the powder and coatings includes body-centered cubic lattice (BCC), its ordered modification (B2), and face-centered cubic lattice FCC phases, which is consistent with the predictions of the Scheil solidification model, describing the process of non-equilibrium solidification, assuming no diffusion in the solid phase and complete mixing in the liquid phase. Rapid solidification and high-speed impact deformation of the powder led to significant grain refinement in the detonation spraying coating, which ultimately improved the mechanical properties at the micro level. The data obtained demonstrate the high efficiency of the AlCoCrFeNi coating applied by detonation spraying and confirm its potential for use in conditions of increased wear and mechanical stress. AlCoCrFeNi coatings may be promising for use as structural materials in the future. Full article
(This article belongs to the Section Crystalline Metals and Alloys)
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13 pages, 2488 KB  
Article
Silicon and Manganese Effect on the Phase Composition of an Al-Fe Alloy and the Use of the ThermoCalc Software Complex for Thermodynamic Analysis
by Bakhtiyar Suleyev, Aristotel Issagulov, Ardak Dostayeva, Dastan Aubakirov and Togzhan Sultanbek
Alloys 2025, 4(2), 10; https://doi.org/10.3390/alloys4020010 - 30 May 2025
Viewed by 885
Abstract
This study examines the effect of silicon and manganese addition on the phase composition and electrical properties of Al-Fe alloys using both experimental methods and thermodynamic modeling with the ThermoCalc software package. This research focuses on the Al–Fe–Si–Mn system, which shows potential for [...] Read more.
This study examines the effect of silicon and manganese addition on the phase composition and electrical properties of Al-Fe alloys using both experimental methods and thermodynamic modeling with the ThermoCalc software package. This research focuses on the Al–Fe–Si–Mn system, which shows potential for developing conductive aluminum alloys with enhanced performance characteristics. It was found that when silicon and manganese are added in amounts up to 0.6%, the formation of intermetallic phases such as Al8Fe2Si and Al15Mn3Si2 occurs. These phases significantly influence the electrical conductivity and mechanical stability of the alloy. Thermodynamic modeling proved effective in predicting phase formation, guiding the selection of alloy compositions, and optimizing heat treatment parameters. The optimal composition for a conductive aluminum alloy includes up to 0.8% Fe, 0.5% Si, and 0.6% Mn. Heat treatment in the range of 500–550 °C resulted in a favorable combination of strength, electrical conductivity, and thermal resistance. The findings support the use of Al–Fe–Si–Mn alloys in electrical and structural applications and demonstrate the value of combining computational and experimental approaches in alloy design. Full article
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19 pages, 6183 KB  
Article
Study on the Austenite Grain Growth Behavior of Fe-Mn-Al-C Low-Density Steel Containing Niobium
by Litu Huo, Tao Ma, Weimin Gao, Yungang Li, Haichao Zhang and Jianxin Gao
Metals 2025, 15(6), 576; https://doi.org/10.3390/met15060576 - 23 May 2025
Cited by 2 | Viewed by 792
Abstract
To explore the impact of niobium (Nb) addition on the austenitization behavior of Fe-Mn-Al-C lightweight steels, the effects were examined through Thermo-Calc thermodynamic simulations, optical microscopy, transmission electron microscopy (TEM), and the development of austenite grain growth models. Three distinct Fe-Mn-Al-C steel compositions, [...] Read more.
To explore the impact of niobium (Nb) addition on the austenitization behavior of Fe-Mn-Al-C lightweight steels, the effects were examined through Thermo-Calc thermodynamic simulations, optical microscopy, transmission electron microscopy (TEM), and the development of austenite grain growth models. Three distinct Fe-Mn-Al-C steel compositions, each containing different Nb contents (0.38%, and 0.56%), were subjected to various austenitization temperatures and aging conditions, and a kinetic model for austenite grain growth was established. The results demonstrate that for heating temperatures below 950 °C, the austenite grain growth rate of the steels was similar. However, at temperatures above 950 °C, the grain growth rate of the steel without Nb (Steel No. 1) increased significantly compared to the niobium-containing alloys. Austenite grain size increased with higher heating temperatures. At constant heating temperatures, longer holding times resulted in larger grain sizes, though the rate of grain size growth diminished over time. Based on the experimental data and the kinetic theory of austenite grain growth, a grain growth model of No. 2 Steel (which contained 0.38% Nb) was established. The predicted grain size values derived from this model closely matched the experimental measurements, indicating a strong correlation and providing valuable insights for future studies. Full article
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15 pages, 6477 KB  
Article
A Metallurgically Informed Multiscale Integrated Computational Framework for Metal Forming Processes
by Vasilis Loukadakis and Spyros Papaefthymiou
Crystals 2025, 15(5), 399; https://doi.org/10.3390/cryst15050399 - 24 Apr 2025
Viewed by 1093
Abstract
: Predicting the mechanical response of industrial alloys is crucial for optimizing manufacturing processes and improving material performance. Traditional, solely experimental approaches, though effective, are inefficient as they are resource-intensive, requiring extensive laboratory testing and the iterative calibration of processing conditions. These costs [...] Read more.
: Predicting the mechanical response of industrial alloys is crucial for optimizing manufacturing processes and improving material performance. Traditional, solely experimental approaches, though effective, are inefficient as they are resource-intensive, requiring extensive laboratory testing and the iterative calibration of processing conditions. These costs can be avoided through computational/virtual experiments based on a multiscale hierarchical framework that integrates macroscopic approaches, mesoscale modelling as well as atomic level and advanced thermodynamical simulations to study and predict the mechanical response of metallic systems. In the context of this work, a framework for studying the effect of forming on metallic materials is proposed, applied, and validated on the hot extrusion of AA6063. Coupling thermodynamic simulations (including Phase Field) results with literature data establishes a microstructurally accurate representative volume element (RVE) design. This way, the phase fraction and the grain size of the RVE are determined by thermodynamic simulations (ThermoCalc, MICRESS), which can be validated via microstructure characterization. It is known that the mechanical properties of the individual phases affect the macroscopical properties of the material. Using atomic level simulations (i.e., molecular dynamics), the dislocation density of the material is calculated and utilized as an input for a Crystal Plasticity Fast Fourier Transformation simulation. This iterative process can be applied to match all stages of manufacturing processes. The hierarchical and systematic integration of these computational methodologies enables a rigorous analysis of the effect that processing parameters have on the microstructure. This work contributes to the broader effort of creating experiment-free workflows for designing materials and processes by leveraging a multiscale modeling approach. Coupled with experimental data, the predictive accuracy of the mechanical behavior can be further enhanced. Full article
(This article belongs to the Special Issue Innovative Insights into Deformation and Failure of Metallic Alloys)
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18 pages, 4191 KB  
Article
Data and Knowledge Dual-Driven Creep Life Prediction for Austenitic Heat-Resistance Steel
by Xiaochang Xie, Mutong Liu, Ping Yang, Zenan Yang, Chengbo Pan, Chenchong Wang and Xiaolu Wei
Metals 2025, 15(2), 120; https://doi.org/10.3390/met15020120 - 25 Jan 2025
Cited by 1 | Viewed by 1127
Abstract
Traditional creep life prediction methods are generally difficult for researchers to fully consider the key factors affecting the creep performance, which limits their application in the research and development of new alloys. The artificial intelligence method can skip the complex mechanism and directly [...] Read more.
Traditional creep life prediction methods are generally difficult for researchers to fully consider the key factors affecting the creep performance, which limits their application in the research and development of new alloys. The artificial intelligence method can skip the complex mechanism and directly establish the mathematical correlation between the composition/process and the target performance. The accuracy, universality, and development efficiency of the model are better than the traditional material development strategy. In this study, we collected 216 creep data of austenitic heat-resistant steel, selected a variety of different machine learning algorithms to establish creep life prediction models, calculated and introduced a large amount of physical metallurgy knowledge highly related to creep based on Thermo-Calc, and converted the creep life into the form of the Larson–Miller parameter to optimize the data distribution, which effectively improved the prediction accuracy and interpretability of the model. In addition, the optimal model was combined with a genetic algorithm to obtain the best composition and process scheme with high-creep-performance potential, providing guidance for the design of austenitic heat-resistant steel. Full article
(This article belongs to the Special Issue Alloy Design and Its Performance Trade-Offs)
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21 pages, 8012 KB  
Article
Effect of Nb Alloying and Solution Treatment on the Mechanical Properties of Cold-Rolled Fe-Mn-Al-C Low-Density Steel
by Litu Huo, Jianxin Gao, Yungang Li, Pengfei Xu, Xiangyu Wei and Tao Ma
Metals 2025, 15(2), 102; https://doi.org/10.3390/met15020102 - 22 Jan 2025
Cited by 5 | Viewed by 1325
Abstract
The automotive industry’s rapid expansion has made the development of lightweight, high-strength automotive steels essential for both energy efficiency and emission reduction. Among these materials, Fe-Mn-Al-C steel has drawn considerable interest due to its favorable combination of low density and high strength. This [...] Read more.
The automotive industry’s rapid expansion has made the development of lightweight, high-strength automotive steels essential for both energy efficiency and emission reduction. Among these materials, Fe-Mn-Al-C steel has drawn considerable interest due to its favorable combination of low density and high strength. This research examines the impact of Nb alloying (with Nb content of 0% and 0.5%) and solution treatment on the microstructure and mechanical properties of cold-rolled Fe-28Mn-10Al-C low-density steel. Various methods were employed, including Thermo-Calc thermodynamic simulations, the Olson–Cohen model, X-ray diffraction (XRD), metallographic microscopy, room-temperature tensile testing, and scanning electron microscopy (SEM). The findings demonstrate that Nb alloying significantly refines the austenite grain structure of the Fe-28Mn-10Al-C steel, improving both strength and ductility in comparison to the 0Nb steel. After solution treatment at 1050 °C for 30 min, the cold-rolling-induced defects are effectively removed, leading to a substantial increase in elongation at fracture (38.14–44.45%) and an ultimate tensile strength exceeding 900 MPa. As the solution treatment temperature increases, the austenite grains coarsen, and the number of twins increases, while yield strength and ultimate tensile strength decrease. However, there is a notable enhancement in ductility, with the material exhibiting a ductile fracture mechanism. These results offer valuable insights and a theoretical foundation for further improving the mechanical properties of Fe-Mn-Al-C low-density steels. Full article
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