Mechanical Response and Plastic Deformation in the B2-NiAl/Fe Interface: Molecular Dynamics Analysis
Bibliographic record
Abstract
No abstract is available for this record. The assistant can identify its topic from the title, but cannot infer the study’s results.
Source: Not provided · Quality: missing
Research context
OpenAlex topics: Intermetallics and Advanced Alloy Properties · Microstructure and mechanical properties · Boron and Carbon Nanomaterials Research
SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.
References (36)
Show source-provided references
1. A. Hirata, T. Fujita, Y.R. Wen, J.H. Schneibe, C.T. Liu, and M.W. Chen, Atomic Structure of Nanoclusters in Oxide-Dispersion-Strengthened Steels, Nat. Mater., 2011, 10, p 922.10.1038/nmat3150 ↗
2. A.J. Ardell, Precipitation Hardening, Metall. Trans. A, 1985, 16, p 2131–2165.10.1007/BF02670416 ↗
3. D.B. Miracle, Overview No. 104 The Physical and mechanical Properties of NiAl, Acta Mater., 1993, 41, p 649–684.10.1016/0956-7151(93)90001-9 ↗
4. S.M. Zhu, S.C. Tjong, and J.K.L. Lai, Creep Behavior of a β’(NiAl) Precipitation Strengthened Ferritic Fe-Cr-Ni-Al Alloy, Acta Mater., 1998, 46, p 2969–2976.10.1016/S1359-6454(98)00022-6 ↗
5. S. Huang, D.L. Worthington, M. Asta, V. Ozolins, G. Ghosh, and P.K. Liaw, Calculation of Impurity Diffusivities in α-Fe Using First-Principles Methods, Acta Mater., 2010, 58, p 1982–1993.10.1016/j.actamat.2009.11.041 ↗
6. Z.K. Teng, M.K. Miller, G. Ghosh, C.T. Liu, S. Huang, K.F. Russell, M.E. Fine, and P.K. Liaw, Characterization of Nanoscale NiAl-Type Precipitates in a Ferritic steel by Electron Microscopy and Atom Probe Tomography, Scripta Mater., 2010, 63, p 61–64.10.1016/j.scriptamat.2010.03.013 ↗
7. Z.K. Teng, C.T. Liu, G. Ghosh, P.K. Liaw, and M.E. Fine, Effects of Al on the Microstructure and Ductility of NiAl-Strengthened Ferritic Steels at Room Temperature, Intermetallics, 2010, 18, p 1437–1443.10.1016/j.intermet.2010.03.026 ↗
8. M. Kapoor, D. Isheim, G. Ghosh, S. Vaynman, M.E. Fine, and Y.W. Chung, Aging Characteristics and Mechanical Properties of 1600 MPa Body-Centered Cubic Cu and B2-NiAl Precipitation-Strengthened Ferritic Steel, Acta Mater., 2014, 73, p 56–74.10.1016/j.actamat.2014.03.051 ↗
9. P. Pauš, J. Kratochvíl, and M. Beneš, A Dislocation Dynamics Analysis of the Critical Cross-Slip Annihilation Distance and the Cyclic Saturation Stress in FCC Single Crystals at Different Temperatures, Acta Mater., 2013, 61, p 7917–7923.10.1016/j.actamat.2013.09.032 ↗
10. M. Dupraz, Z. Sun, C. Brandl, and H. Van Swygenhoven, Dislocation Interactions at Reduced Strain Rates in Atomistic Simulations of Nanocrystalline Al, Acta Mater., 2018, 144, p 68–79.10.1016/j.actamat.2017.10.043 ↗
11. Z.K. Teng, F. Zhang, M.K. Miller, C.T. Liu, S. Huang, Y.T. Chou, R.H. Tien, Y.A. Chang, and P.K. Liaw, New NiAl-Strengthened Ferritic Steels with Balanced Creep Resistance and Ductility Designed by Coupling Thermodynamic Calculations with Focused Experiments, Intermetallics, 2012, 29, p 110–115.10.1016/j.intermet.2012.05.007 ↗
12. Z.K. Teng, G. Ghosh, M.K. Miller, S. Huang, B. Clausen, D.W. Brown, and P.K. Liaw, Neutron-Diffraction Study and Modeling of the Lattice Parameters of a NiAl-Precipitate-Strengthened Fe-Based Alloy, Acta Mater., 2012, 60, p 5362–5369.10.1016/j.actamat.2012.05.033 ↗
13. S.H. Jiang, H. Wang, Y. Wu, X.J. Liu, H.H. Chen, M.J. Yao, B. Gault, D. Ponge, D. Raabe, A. Hirata, M.W. Chen, Y.D. Wang, and Z.P. Lu, Ultrastrong Steel Via Minimal Lattice Misfit and High-Density Nanoprecipitation, Nature, 2017, 544, p 460–464.10.1038/nature22032 ↗
14. Q. Jiang and H.M. Lu, Size Dependent Interface Energy and Its Applications, Surf. Sci. Rep., 2008, 63, p 427–464.10.1016/j.surfrep.2008.07.001 ↗
15. Y. Zhao, Q. Fang, Y. Liu, P. Wen, and L. Yong, Creep Behavior as dislocation Climb Over NiAl Nanoprecipitates in Ferritic Alloy: The Effects of Interface Stresses and Temperature, Int. J. Plast., 2015, 69, p 89–101.10.1016/j.ijplas.2015.02.006 ↗
16. J. Sakurai and S. Hata, Search for Ti-Ni-Zr Thin Film Metallic Glasses Exhibiting a Shape Memory Effect After Crystallization, Mater. Sci. Eng. A, 2012, 541, p 8–13.10.1016/j.msea.2012.01.075 ↗
17. W. Liu, J.C. Li, W.T. Zheng, and Q. Jiang, NiAl(110)/Cr(110) interface: A Density Functional Theory Study, Phys. Rev. B, 2006, 73, p 205421.1–205421.7.10.1103/PhysRevB.73.205421 ↗
18. X.W. Zhou, R.A. Johnson, and H.N.G. Wadley, Misfit-Energy-Increasing Dislocations in Vapor-Deposited CoFe/NiFe Multilayers, Phys. Rev. B, 2004, 69, p 144113.10.1103/PhysRevB.69.144113 ↗
19. W.C. Yu and Y. Tao, Investigation of Structure and Energy of Edge Dislocation in BCC Iron, Acta Phys. Sin., 2006, 55, p 5980–5986.10.7498/aps.55.5980 ↗
20. J.A. Yan, C.Y. Wang, and S.Y. Wang, Generalized-Stacking-Fault Energy and Dislocation Properties in BCC Fe: A First-Principles Study, Phys. Rev. B, 2004, 70, p 174105.1–174105.5.10.1103/PhysRevB.70.174105 ↗
21. M.R. Gilbert, S. Queyreau, and J. Marian, Stress and Temperature Dependence of Screw Dislocation Mobility in α-Fe by Molecular Dynamics, Phys. Rev. B, 2011, 84, p 174103.1–174103.11.10.1103/PhysRevB.84.174103 ↗
22. T. Zhu and C.Y. Wang, Misfit Dislocation Networks in the γ/γ’ Phase Interface of a Ni-Based Single-Crystal Superalloy: Molecular Dynamics Simulations, Phys. Rev. B, 2005, 72, p 014111.10.1103/PhysRevB.72.014111 ↗
23. M.R. An, H.Y. Song, Q. Deng, M.J. Su, and Y.M. Liu, Influence of Interface with Mismatch Dislocations on Mechanical Properties of Ti/Al Nanolaminate, J. Appl. Phys., 2019, 125, p 165307.10.1063/1.5085455 ↗
24. S.D. Chen, Y.K. Zhou, and A.K. Soh, Molecular Dynamics Simulations of Mechanical Properties for Cu(001)/Ni(001) Twist Boundaries, Comput. Mater. Sci., 2012, 61, p 239–242.10.1016/j.commatsci.2012.04.035 ↗
25. I. Adlakha, M.A. Tschopp, and K.N. Solanki, The Role of Grain Boundary Structure and Crystal Orientation on Crack Growth Asymmetry in Aluminum, Mater. Sci. Eng. A, 2014, 618, p 345–354.10.1016/j.msea.2014.08.083 ↗
26. S.J. Plimpton, Fast Parallel Algorithms for Short-Range Molecular Dynamics, J. Comput. Phys., 1995, 117, p 1–19.10.1006/jcph.1995.1039 ↗
27. A. Stukowski, Visualization and Analysis of Atomistic Simulation Data with OVITO-the Open Visualization Tool, Model. Simul. Mater. Sc., 2010, 18, p 015012.10.1088/0965-0393/18/1/015012 ↗
28. A. Stukowski, V.V. Bulatov, and A. Arsenlis, Automated Identification and Indexing of Dislocations in Crystal Interfaces, Model. Simul. Mater. Sc., 2012, 20, p 085007.10.1088/0965-0393/20/8/085007 ↗
29. K.S. Shin, H. Kwak, C. Zou, A.V. Vasenkov, and A.C.T.V. Duin, Development and Validation of a ReaxFF Reactive Force Field for Fe/Al/Ni Alloys: Molecular Dynamics Study of Elastic Constants, Diffusion, and Segregation, J. Phys. Chem. A, 2012, 116, p 12163–12174.10.1021/jp308507x ↗
30. F.P. Yuan, Atomistic Simulation Study of Tensile Deformation in Bulk Nanocrystalline BCC Iron, Sci. China Phys. Mech., 2012, 55, p 1657–1663.10.1007/s11433-012-4830-6 ↗
31. K.S. Cheung, R.J. Harrison, and S. Yip, Stress Induced Martensitic Transition in a Molecular Dynamics Model of α-Iron, J. Appl. Phys., 1992, 71, p 4009–4014.10.1063/1.350846 ↗
32. K.J. Caspersen, A. Lew, M. Ortiz, and E.A. Carter, Importance of Shear in the BCC-to-HCP Transformation in Iron, Phys. Rev. Lett., 2004, 93, p 115501.10.1103/PhysRevLett.93.115501 ↗
33. R.D. Taylor, M.P. Pasternak, and R. Jeanloz, Hysteresis in the High Pressure Transformation of BCC- to HCP-Iron, J. Appl. Phys., 1991, 69, p 6126–6128.10.1063/1.348779 ↗
34. D.F. Johnson and E.A. Carter, Nonadiabaticity in the Iron BCC to HCP Phase Transformation, J. Chem. Phys., 2008, 128, p 104703.10.1063/1.2883592 ↗
35. M. Friák and M. Šob, Ab Initio Study of the BCC-HCP Transformation in Iron, Phys. Rev. B, 2008, 77, p 249–255.10.1103/PhysRevB.77.174117 ↗
36. M. Ekman, B. Sadigh, K. Einarsdotter, and P. Blaha, Ab Initio Study of the Martensitic BCC-HCP Transformation in Iron, Phys. Rev. B, 1998, 58, p 5296–5304.10.1103/PhysRevB.58.5296 ↗