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Strategies for High-Temperature Corrosion Simulations of Fe-Based Alloys Using the Calphad Approach: Part I
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The environmental degradation of materials at high temperatures limits the useful life of different industrial components and hinders the development of more economical and environmentally friendly processes for the energy production. Despite the importance of this phenomena, a model to predict lifetime of materials that degrade due to high-temperature corrosion has up till now been lacking due to limitations of the computational possibilities and the complex nature of oxidation. In the present work we develop some strategies to model high-temperature corrosion in Fe-based alloys using the Calphad (Calculation of Phase Diagrams) approach. It is proposed that kinetic-based simulations for oxidation of Al and Cr can accurately represent the lifetime of the protective layers in FeCrAl and FeCr alloys at different temperatures in air. The oxide systems are in addition investigated by equilibrium calculations. The corrosion mechanisms of FeCr and FeCrAl alloys are discussed based on theoretical and experimental knowledge.
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The primary corrosion protection of FeCrAl alloys ((Al,Cr)2O3) acts similar to the Cr-rich type of oxide scale at intermediately high temperatures, e.g. 600°C.
“The results from this study also indicate that the primary corrosion protection of FeCrAl alloys ((Al,Cr) 2 O 3 ) act similar to the Cr-rich type of oxide scale at intermediately high temperatures, e.g.600 • C, in good agreement with recent investigations [35,40].”
From Beyond breakaway corrosion – Influence of chromium, nickel and aluminum on corrosion of iron-based alloys at 600 °C (2020) · cites this paper as [40]
Section 2.2.3 says an oxide with properties similar to the protective Cr-rich scale forms on FeCrAl alloys at 600 °C, and proposes that Cr oxidation provides their oxidation resistance at that temperature. But Section 2.1 says the thin scale’s microstructure is not well characterized and reports only a small amount of Al in it; the paper does not establish the claimed (Al,Cr)₂O₃ composition. (LLM, conf=0.86)
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Alkali Induced High Temperature Corrosion of Stainless Steel: The Influence of NaCl, KCl and CaCl2
Karlsson, S., Pettersson, J., Johansson, L. G., & Svensson, J. E. (2012) · Oxidation of Metals · doi:10.1007/s11085-012-9293-7 · Cited by 118
Initial Stages of the HCl-Induced High-Temperature Corrosion of Alloy 310
Folkeson, N., Johansson, L.-G., & Svensson, J.-E. (2007) · Journal of The Electrochemical Society · doi:10.1149/1.2754174 · Cited by 66
Paralinear Oxidation of Chromium in O2 + H2O Environment at 600–700 °C
Pujilaksono, B., Jonsson, T., Halvarsson, M., Panas, I., Svensson, J.-E., & Johansson, L.-G. (2008) · Oxidation of Metals · doi:10.1007/s11085-008-9114-1 · Cited by 59
Self-citationIsraelsson, N., Unocic, K. A., Hellström, K., Jonsson, T., Norell, M., Svensson, J.-E., & Johansson, L.-G. (2015) · Oxidation of Metals · doi:10.1007/s11085-015-9546-3 · Cited by 54
Self-citationPersdotter, A., Eklund, J., Liske, J., & Jonsson, T. (2020) · Corrosion Science · doi:10.1016/j.corsci.2020.108961 · Cited by 44 · cited 7×
“no such grain growth is observed in the chromia layer formed on these alloys [1] or on ‘‘pure Cr’’ for short time exposures and 600 C [20] .”
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Research works printed but not linked: 68
- P. Kofstad, High Temperature Corrosion (Elsevier Applied Science, London, 1988)
- N. Birks, G. Meier, and F. Pettit, Introduction to the High Temperature Oxidation of Metals (Cambridge University Press, Cambridge, 2006) · DOI · Paper page
- D.J. Young, High Temperature Oxidation and Corrosion of Metals (Elsevier, Amsterdam, 2008)
- L. Kaufman and J. Ågren, CALPHAD, First and Second Generation-Birth of the Materials Genome. Scr. Mater. 70, 3-6 (2014) · DOI
- N. Saunders and P. Miodownik, CALPHAD—A Comprehensive Guide (Pergamon Press, Oxford, 1998)
- H. Lukas, S. Fries, and B. Sundman, Computational Thermodynamics (Cambridge University Press, Cambridge, 2007) · DOI
- M. Hillert, Phase Equilibria. Their Thermodynamic Basis, Phase Diagrams and Phase Transformations (Cambridge University Press, Cambridge, 2008)
- C. Wagner, Passivity and Inhibition During the Oxidation of Metals at Elevated Temperatures. Corrosion Science 5, 751 (1965) · DOI
- T. Narita, Computer Simulation of the Diffusional Growth of Ternary Oxide Scales on Binary Alloys. J. Electrochem. Soc. 129(1), 209 (1982) · DOI
- U. Krupp, V. Trindade, P. Schmidt, H.-J. Christ, U. Buschmann, and W. Wiechert, Oxidation Mechanisms of Cr-Containing Steels and Ni-Base Alloys at High Temperatures Part II: Computer-Based Simulation. Mater. Corros. 57(3), 263-268 (2006) · DOI
- C. Toffolon-Masclet, A. Perron, B. Mazères, S. Dépinoy, C. Desgranges, L. Martinelli, D. Monceau, X. Boulnat, A. Mathevon, and M. Perez, Computational Kinetics: Application to Nuclear Materials, 2020, vol. 1. · DOI
- M.V. Glazoff, A. Tokuhiro, S.N. Rashkeev, and P. Sabharwall, Oxidation and Hydrogen Uptake in Zirconium, Zircaloy-2 and Zircaloy-4: Computational Thermodynamics and Ab initio Calculations. Journal of Nuclear Materials 444(1–3), 65-75 (2014) · DOI
- T.J. Nijdam, L.P. Jeurgens, and W.G. Sloof, Modelling the Thermal Oxidation of Ternary Alloys—Compositional Changes in the Alloy and the Development of Oxide Phases. Acta Mater. 51(18), 5295-5307 (2003) · DOI
- T.J. Nijdam and W.G. Sloof, Modelling of Composition and Phase Changes in Multiphase Alloys Due to Growth of an Oxide Layer. Acta Mater. 56(18), 4972-4983 (2008) · DOI
- R. Pillai, W.G. Sloof, A. Chyrkin, L. Singheiser, and W.J. Quadakkers, A New Computational Approach for Modelling the Microstructural Evolution and Residual Lifetime Assessment of MCrAlY Coatings. Mater. High Temp. 32(1–2), 57-67 (2015) · DOI
- A. Chyrkin, W.G. Sloof, R. Pillai, T. Galiullin, D. Grüner, L. Singheiser, and W.J. Quadakkers, Modelling Compositional Changes in Nickel Base Alloy 602 CA During High Temperature Oxidation. Mater. High Temp. 32(1–2), 102-112 (2015) · DOI
- N. Ta, L. Zhang, Q. Li, Z. Lu, and Y. Lin, High-Temperature Oxidation of Pure Al: Kinetic Modeling Supported by Experimental Characterization. Corros. Sci. 139, 355-369 (2018) · DOI
- S. Hallström, M. Halvarsson, L. Höglund, T. Jonsson, and J. Ågren, High Temperature Oxidation of Chromium: Kinetic Modeling and Microstructural Investigation. Solid State Ion. 240, 41-50 (2013) · DOI
- S. Hallström, L. Höglund, and J. Ågren, Modeling of Iron Diffusion in the Iron Oxides Magnetite And Hematite with Variable Stoichiometry. Acta Mater. 59(1), 53-60 (2011) · DOI · Paper page
- H. Larsson, T. Jonsson, R. Naraghi, Y. Gong, R.C. Reed, and J. Ågren, Oxidation of Iron at 600 $$^\circ $$C—Experiments and Simulations. Mater. Corros. 68, 30 (2016)
- M. Bensch, A. Sato, N. Warnken, E. Affeldt, R.C. Reed, and U. Glatzel, Modelling of High Temperature Oxidation of Alumina-forming Single-Crystal Nickel-base Superalloys. Acta Mater. 60(15), 5468-5480 (2012) · DOI
- Y. Gong, D.J. Young, P. Kontis, Y.L. Chiu, H. Larsson, A. Shin, J.M. Pearson, M.P. Moody, and R.C. Reed, On the Breakaway Oxidation of Fe9Cr1Mo Steel in High Pressure $${CO}_2$$. Acta Mater. 130, 361-374 (2017) · DOI
- S. Hallström, On High Temperature Oxidation Resistance, Towards the Materials Genome of High Temperature Alloys. KTH Royal Institute of Technology, PhD Thesis (2014).
- R. Freer, Self-Diffusion and Impurity Diffusion in Oxides. J. Mater. Sci. 15(4), 803-824 (1980) · DOI
- J.A. Van Orman and K.L. Crispin, Diffusion in Oxides. Rev. Mineral. Geochem. 72, 757-825 (2010) · DOI · Paper page
- A. Atkinson, Diffusion Along Grain Boundaries and Dislocations in Oxides, Alkali Halides and Carbides. Solid State Ion. 12, 309-320 (1984) · DOI
- I. Kaur and W. Gust, Fundamentals of Grain and Interphase Boundary Diffusion (ZieglerPress, Stuttgart, 1989)
- L.G. Harrison, Influence of Dislocations on Diffusion Kinetics in Solids with Particular Reference to the Alkali Halides. Trans. Faraday Soc. 57, 1191-1199 (1961) · DOI
- J.S. Dunning, D.E. Alman, and J.C. Rawers, Influence of Silicon and Aluminum Additions on the Oxidation Resistance of a Lean-chromium Stainless Steel. Oxid. Met. 57(5–6), 409-425 (2002) · DOI
- R. Bauer, M. Baccalaro, L.P. Jeurgens, M. Pohl, and E.J. Mittemeijer, Oxidation Behavior of Fe-25Cr-20Ni-2.8Si During Isothermal Oxidation at 1286 K; Life-Time Prediction. Oxid. Met. 69(3–4), 265-285 (2008) · DOI
- J. Eklund, B. Jönsson, A. Persdotter, J. Liske, J.-E. Svensson, and T. Jonsson, The Influence of Silicon on the Corrosion Properties of FeCrAl Model Alloys in Oxidizing Environments at 600 $$^{\circ }$$C. Corros. Sci. 144(November), 266-276 (2018) · DOI · Paper page
- J. Eklund, Material Solutions for Mitigating High Temperature Corrosion in Biomass- and Waste-fired Boilers. Chalmers Reproservice, Licentiate thesis (2018).
- H. Josefsson, F. Liu, J.-E. Svensson, M. Halvarsson, and L.G. Johansson, Oxidation of FeCrAI Alloys at 500–900 $$^\circ $$C in Dry $$O_2$$. Mater. Corros. 56(11), 801-805 (2005) · DOI
- H. Josefsson, F. Liu, J.-E. Svensson, M. Halvarsson, and L.-G. Johansson, The Formation of Oxide Scale on FeCrAl at 900 $$^\circ $$C in $$O_2$$,” in Proceedings - Electrochemical Society, vol. 16 (2004).
- F. Liu, H. Josefsson, J.-E. Svensson, L.G. Johansson, and M. Halvarsson, TEM Investigation of the Oxide Scales Formed on a FeCrAlRE alloy (Kanthal AF) at 900 $$^\circ $$C in dry $$O_2$$ and $$O_2$$ with 40% $$H_2O$$. Mater. High Temp. 22(3–4), 521-526 (2005) · DOI
- F.H. Stott, The Oxidation of Alumina-forming Alloys. Mater. Sci. Forum 251–254, 19-32 (1997) · DOI
- T. Jonsson, S. Karlsson, H. Hooshyar, M. Sattari, J. Liske, J.E. Svensson, and L.G. Johansson, Oxidation After Breakdown of the Chromium-rich Scale on Stainless Steels at High Temperature: Internal Oxidation. Oxid. Met. 85(5–6), 509-536 (2016) · DOI · Paper page
- C. Pettersson, T. Jonsson, C. Proff, M. Halvarsson, J.-E. Svensson, and L.G. Johansson, High Temperature Oxidation of the Austenitic (35Fe27Cr31Ni) Alloy Sanicro 28 in $$O_2+H_2O$$ Environment. Oxid. Met. 74(1–2), 93-111 (2010) · DOI
- T. Jonsson, S. Canovic, F. Liu, H. Asteman, J.E. Svensson, L.G. Johansson, and M. Halvarsson, Microstructural Investigation of the Effect Of Water Vapour on the Oxidation of Alloy 353 MA in Oxygen at 700 and 900 $$^\circ $$C. Mater. High Temp. 22(3–4), 231-243 (2005) · DOI
- T. Jonsson, N. Folkeson, M. Halvarsson, J.E. Svensson, and L.G. Johansson, Microstructural Investigation of the HCl-Induced Corrosion of the Austenitic Alloy 310S (52Fe26Cr19Ni) at 500 $$^\circ $$C. Oxid. Met. 81(5–6), 575-596 (2014) · DOI
- T. Jonsson, B. Pujilaksono, H. Heidari, F. Liu, J.-E. Svensson, M. Halvarsson, and L.G. Johansson, Oxidation of Fe-10Cr in $$O_2$$ and in $$O_2+H_2O$$ Environment at 600 $$^\circ $$C: A Microstructural Investigation. Corros. Sci. 75, 326-336 (2013) · DOI · Paper page
- B. Pujilaksono, T. Jonsson, H. Heidari, M. Halvarsson, J.E. Svensson, and L.G. Johansson, Oxidation of Binary FeCr Alloys (Fe-2.25Cr, Fe-10Cr, Fe-18Cr and Fe-25Cr) in $$O_2$$ and in $$O_2+H_2O$$ Environment at 600 $$^{\circ }$$C. Oxid. Met. 75(3–4), 183-207 (2011) · DOI · Paper page
- D. Mortimer and W.B. Sharp, Oxidation of Fe-Cr Binary Alloys. Br. Corros. J. 3(2), 61-67 (1968) · DOI
- C.P. Jensen, D.F. Mitchell, and M.J. Graham, Influence of the Prior Oxide Film on the Growth and Structure of Oxides Formed on Fe-26Cr Alloys at 600 $$^{\circ }$$C. Corros. Sci. 22(12), 1125-1150 (1982) · DOI
- C. Leygraf and G. Hultquist, Initial Oxidation Stages on FeCr(100) and FeCr(110) Surfaces. Surf. Sci. 61(1), 69-84 (1976) · DOI
- C. Leygraf, G. Hultquist, and S. Ekelund, A LEED/AES Study of the Oxidation of Fe0.84Cr0.16 (100) and (110). Surf. Sci. 51(2), 409-432 (1975) · DOI
- H.E. Evans, D.A. Hilton, and R.A. Holm, Chromium-Depleted Zones and the Oxidation Process in Stainless Steels. Oxid. Met. 10(3), 149-161 (1976) · DOI
- F.H. Stott and F.I. Wei, High Temperature Oxidation of Commercial Austenitic Stainless Steels. Mater. Sci. Technol. (U.K.) 5(11), 1140-1147 (1989) · DOI
- S. Canovic, J. Froitzheim, R. Sachitanand, M. Nikumaa, M. Halvarsson, L.-G. Johansson, and J.-E. Svensson, Oxidation of Co- and Ce-Nanocoated FECR Steels: A Microstructural Investigation. Surf. Coat. Technol. 215, 62-74 (2013) · DOI
- C.O. Olsson and D. Landolt, Passive Films on Stainless Steels-Chemistry, Structure and Growth. Electrochim. Acta 48(9), 1093-1104 (2003) · DOI
- H. Götlind, F. Liu, J.-E. Svensson, M. Halvarsson, and L.G. Johansson, The Effect of Water Vapor on the Initial Stages of Oxidation of the FeCrAl Alloy Kanthal AF at 900 $$^\circ $$ C. Oxid. Met. 67(5–6), 251-266 (2007) · DOI
- J. Engkvist, S. Canovic, F. Liu, H. Götlind, J.E. Svensson, L.G. Johansson, M. Olsson, and M. Halvarsson, Oxidation of FeCrAl Foils at 500–900 $$^{\circ }$$C in Dry $$O_2$$ and $$O_2$$ with 40% $$H_2O$$. Mater. High Temp. 26(2), 199-210 (2009) · DOI
- J.-O. Andersson, T. Helander, L. Höglund, P. Shi, and B. Sundman, Thermo-Calc & DICTRA, Computational Tools for Materials Science. Calphad 26(2), 273–312 (2002) · DOI · Paper page
- H. Larsson and A. Engström, A Homogenization Approach to Diffusion Simulations Applied to $$\alpha $$ + $$\gamma $$ Fe-Cr-Ni Diffusion Couples. Acta Mater. 54(9), 2431-2439 (2006) · DOI
- J. Pettersson, N. Folkeson, L.G. Johansson, and J.-E. Svensson, The Effects of KCl, $$K_2SO_4$$ and $$K_2CO_3$$ on the High Temperature Corrosion of a 304-Type Austenitic Stainless Steel. Oxid. Met. 76(1–2), 93-109 (2011) · DOI · Paper page
- C. Pettersson, L.G. Johansson, and J.-E. Svensson, The Influence of Small Amounts of KCl(s) on the Initial Stages of the Corrosion of Alloy Sanicro 28 at 600 $$^{\circ }$$C. Oxid. Met. 70(5–6), 241-256 (2008) · DOI · Paper page
- F. Stott, G. Wood, and J. Stringer, The Influence of Alloying Elements on the Development and Maintenance of Potective Scales. Oxid. Met. 44(1–2), 113-145 (1995) · DOI
- Z.G. Zhang, F. Gesmundo, P.Y. Hou, and Y. Niu, Criteria for the Formation of Protective $$Al_2O_3$$ Scales on Fe-Al and Fe-Cr-Al Alloys. Corros. Sci. 48(3), 741–765 (2006) · DOI
- A.H. Iyer, G. Mohanty, K. Stiller, J. Michler, and M. Colliander, Microscale Fracture of Chromia Scales. Materialia 8 (2019) · DOI
- G. Lindwall, X.L. Liu, A. Ross, H. Fang, B.C. Zhou, and Z.K. Liu, Thermodynamic Modeling of the Aluminum-Iron-Oxygen System. Calphad Comput. Coupl. Phase Diagrams Thermochem. 51, 178-192 (2015) · DOI
- Y. Murakami, A. Sawata, and Y. Tsuru, Crystallization Behavior of Amorphous Solid Solutions and Phase Separation in the $$Cr_2O_3-Fe_2O_3$$ System. J. Mater. Sci. 34(5), 951-955 (1999) · DOI
- A.M. Somiya, Phase Equilibrium Studies in the System Iron Oxide-$$Al_2O_3-Cr_2O_3$$. J. Am. Ceram. Soc. 42(12), 603 (1959) · DOI
- P. Saltykov, O. Fabrichnaya, J. Golczewski, and F. Aldinger, Thermodynamic Modeling of Oxidation of Al-Cr-Ni Alloys. J. Alloys Compd. 381(1–2), 99-113 (2004) · DOI
- E. N. Coker, The Oxidation of Aluminum at High Temperature Studied by Thermogravimetric Analysis and Differential Scanning Calorimetry. Sandia Report, no. October, 2013. · DOI
- A.M. Huntz, G.B. Abderrazik, G. Moulin, E.W. Young, and J.H. De Wit, Yttrium Influence on the Alumina Growth Mechanism on an FeCr23Al5 Alloy. Appl. Surf. Sci. 28(4), 345-366 (1987) · DOI
- S. M. Klotsman and I. S. Timofeyev, and A.N. Traktenbeg, Fiz Metal Metalloved, vol. 23, pp. 257-261 (1967).
- G. Stechauner and E. Kozeschnik, “Assessment of Substitutional Self-Diffusion Along Short-Circuit Paths in Al, Fe and Ni,” Calphad, vol. 47, pp. 92-99. · DOI
- M. Hillert, The Compound Energy Formalism. J. Phase Equilib. Diffus. 35(6), 735-760 (2014) · DOI
Cited by
Sorted by citations
Persdotter, A., Eklund, J., Liske, J., & Jonsson, T. (2020) · Corrosion Science · doi:10.1016/j.corsci.2020.108961 · Cited by 44
Self-citationSsenteza, V., Eklund, J., Bigdeli, S., & Jonsson, T. (2024) · Corrosion Science · doi:10.1016/j.corsci.2023.111654 · Cited by 23
Self-citation
Metadata
- Authors
- Bigdeli, S., Kjellqvist, L., Naraghi, R., Höglund, L., Larsson, H., & Jonsson, T.
- Affiliations
- Chalmers University of Technology (SE)
- KTH Royal Institute of Technology (SE)
- Corresponding author
- Bigdeli, Sedigheh
- Venue
- Journal of Phase Equilibria and Diffusion
- Published
- 2021-06
- Volume
- 42
- Issue
- 3
- Pages
- 403-418
- ISSN
- 1547-7037 (ISSN-L)
- 1863-7345
- OpenAlex
- W3174045733
- Cited by
- 19
- References
- 5
- Citations by year
- 2026: 3 · 2025: 7 · 2024: 3 · 2023: 2 · 2022: 4
- FWCI
- 1.13
- Type
- journal article
- Language
- en
- Open access
- hybrid
- doi.org
- Licence
- Locations
- Journal of Phase Equilibria and Diffusion (publishedVersion, cc-by)
- Chalmers Research (Chalmers University of Technology) (submittedVersion, cc-by)
- Funders
- Chalmers University of Technology
- Topics
- Physical Sciences › Materials Science › Surfaces, Coatings and Films › High-Temperature Coating Behaviors
- Physical Sciences › Engineering › Mechanical Engineering › High Temperature Alloys and Creep
- Physical Sciences › Materials Science › Metals and Alloys › Metallurgical Processes and Thermodynamics
- Keywords
- high-temperature corrosion, iron alloys, FeCrAl alloys, Fe-Cr alloys, oxidation kinetics, aluminum oxidation, chromium oxidation, protective oxide scale, lifetime prediction, corrosion mechanism
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