journal article·2023-07

First-principles study on effects of X (Ta, Ti, and W) on the nitriding behavior of γ′-Ni3Al in Ni-based superalloys: From the surface adsorption and diffusion of nitrogen

Luyao Hao, Yang Bai, Yongxin Liu, Xiaowei Lei, Wenjing Yao, Nan Wang

Publisher page

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: Aluminum Alloys Composites Properties · Advanced ceramic materials synthesis · Intermetallics and Advanced Alloy Properties

SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.

References (52)

Show source-provided references
1. Enhancing the microstructure and properties of titanium alloys through nitriding and other surface engineering methods10.1016/j.surfcoat.2004.07.115 ↗
2. Laser nitriding of metals10.1016/S0079-6425(00)00003-7 ↗
3. Intensified plasma-assisted processing: science and engineering10.1016/S0257-8972(01)01441-4 ↗
4. Swelling of 316L austenitic stainless steel induced by plasma nitriding10.1007/s10853-011-5494-8 ↗
5. Co-existence of γ'N phase and γN phase on nitrided austenitic Fe-Cr-Ni alloys- I. experiment10.1016/j.actamat.2019.07.019 ↗
6. A simple model for nitrogen-induced lattice expansion of γ'N and γN phases in Fe-Cr-Ni alloys with different chromium contents10.1080/09500839.2020.1789234 ↗
7. S-phase surface engineering of Fe-Cr, Co-Cr and Ni-Cr alloys10.1179/095066009X12572530170589 ↗
8. Nitridation of Ni-based alloys: thermodynamics, kinetics, and deformation phenomena accompanying internal precipitation10.1016/S1001-0521(06)60091-0 ↗
9. Synthesis, characterization and properties of intensified plasma-assisted nitrided superalloy Inconel 71810.1016/j.surfcoat.2006.01.034 ↗
10. Low temperature gaseous nitriding of Ni based superalloys10.1179/026708409X12490360426043 ↗
11. Plasma assisted nitriding of Inconel 69010.1016/S0257-8972(01)01243-9 ↗
12. Characterisation of nitrogen-bearing surface layers on Ni-base superalloys10.1016/j.wear.2007.01.089 ↗
13. Plasma assisted nitriding of Ni-based superalloys with various microstructures10.1016/j.surfcoat.2013.07.060 ↗
14. Plasma nitriding response at 400 degrees C of the single crystalline Ni-based superalloy MC210.1007/s10853-012-6915-z ↗
15. Effect of plasma nitriding parameters on the wear resistance of alloy Inconel 71810.1007/s11041-016-0037-1 ↗
16. Nitriding kinetics of Inconel 60010.1016/j.surfcoat.2013.03.040 ↗
17. Low temperature nitriding behaviour of Ni3Al-like γ' precipitates in nickel-based superalloys10.1016/j.jallcom.2018.08.187 ↗
18. Adsorption, dissociation, penetration, and diffusion of N2 on and in bcc Fe: first-principles calculations10.1039/c3cp44367a ↗
19. First-principles analysis on the role of rare-earth doping in affecting nitrogen adsorption and diffusion at Fe surface towards clarified catalytic diffusion mechanism in nitriding10.1016/j.actamat.2020.06.020 ↗
20. Distinct nitriding behaviors of γ and γ′ phases in Ni-based superalloys: A fist-principles study10.1016/j.jallcom.2022.165996 ↗
21. Alloying behaviour of Ni3Al, Ni3Ga, Ni3Si and Ni3Ge10.1016/0001-6160(84)90057-9 ↗
22. Alloying element additions to Ni3Al: site preferences and effects on elastic properties form first-principles calculations10.1016/j.commatsci.2011.09.016 ↗
23. Strengthening effects of alloying elements W and Re on Ni3Al: A first-principles study10.1016/j.commatsci.2017.11.047 ↗
24. Effects of alloying elements and temperature on the elastic properties of dilute Ni-base superalloys from first-principles calculations10.1063/1.4749406 ↗
25. An atom probe tomography study of site preference and partitioning in a nickel-based superalloy10.1016/j.actamat.2016.11.053 ↗
26. Site preference of transition metal elements in Ni3Al10.1016/j.scriptamat.2006.05.016 ↗
27. Chromium and tantalum site substitution patterns in Ni3Al (L1(2)) gamma'-precipitates10.1063/1.2956398 ↗
28. Transition-metal alloying of γ’-Ni3Al: Effects on the ideal uniaxial compressive strength from first-principles calculations10.1103/PhysRevB.97.024101 ↗
29. The site preference and doping effect on mechanical properties of Ni3Al-based γ′ phase in superalloys by combing first-principles calculations and thermodynamic model10.1016/j.arabjc.2022.104278 ↗
30. The Ordering Behavior of Co3Al-based γ′ Phase with L12 Structure Predicted by the Thermodynamic Model with Support of First-principles Calculations
31. Ab initio molecular dynamics for liquid metals10.1103/PhysRevB.48.13115 ↗
32. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set10.1103/PhysRevB.54.11169 ↗
33. Projector augmented-wave method10.1103/PhysRevB.50.17953 ↗
34. Generalized gradient approximation made simple10.1103/PhysRevLett.77.3865 ↗
35. The high-temperature thermal expansion of Ni3Al measured by X-ray diffraction and dilation methods
36. Comparison of O adsorption on Ni3Al (001), (011), and (111) surfaces through first-principles calculations10.1016/j.physb.2012.03.021 ↗
37. Atomic structure of alloy surfaces. III. Ni3Al{110}10.1103/PhysRevB.34.6775 ↗
38. The Ni3Al(111) surface structure: experiment and theory
39. Atomic structure of alloy surfaces. II. Ni3Al{111}10.1103/PhysRevB.34.6770 ↗
40. First-principles calculation of hydrogen adsorption and diffusion on Mn-doped Mg2Ni (010) surfaces10.1016/j.apsusc.2017.07.006 ↗
41. Carbon adsorption on doped cementite surfaces for effective catalytic growth of diamond-like carbon: a first-principles study10.1039/C7CP06598A ↗
42. Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points10.1063/1.1323224 ↗
43. A generalized solid-state nudged elastic band method10.1063/1.3684549 ↗
44. Atomic structure and electronic properties of Ni3Al(111) and (011) surface10.1103/PhysRevB.76.045101 ↗
45. Co-alloying effects on the site preference and the elastic properties of γ’-Ni3Al from first-principles calculations10.1063/5.0027684 ↗
46. Theoretical surface science and catalysis-calculations and concepts10.1016/S0360-0564(02)45013-4 ↗
47. Carbon atom adsorption on and diffusion into Fe(110) and Fe(100) from first principles10.1103/PhysRevB.71.045402 ↗
48. Carbon dissolution and diffusion in ferrite and austenite from first principles10.1103/PhysRevB.67.214103 ↗
49. The nature and origin of “double expanded austenite” in Ni-Based Ni-Ti alloys developing upon low temperature gaseous nitriding10.1007/s11661-015-2999-9 ↗
50. Effects of rare-earth elements on the oxidation behavior of γ-Ni in Ni-based single crystal superalloys: A first-principles study from a perspective of surface adsorption10.1016/j.apsusc.2021.149173 ↗
51. Adsorption and diffusion of H and O on the Ni(111) surface containing different amounts of Cr10.1016/j.apsusc.2018.03.134 ↗
52. Effects of rare earth elements on the characteristics of low temperature plasma nitrocarburized martensitic stainless steel10.1016/S1005-0302(12)60171-6 ↗