Unraveling the effects of Cr interface segregation on precipitation mechanism and mechanical properties of MC carbides in high carbon chromium bearing steels

Abstract

This study explored the influence of Cr interfacial segregation on the precipitation mechanism and mechanical properties of MC carbides in high-carbon chromium bearing steels. The precipitation of Cr-doped MC carbides at different concentrations was investigated using microscopic morphological characterization (SEM, EDS and HR-TEM) alongside first principles calculations. The results indicated that both the austenite matrix and MC carbides exhibited, FCC structures, and the following orientation relationships of crystal planes in high-carbon chromium bearing steels were as follows: MC (010)//FCC-Fe (100) and MC (111)//FCC-Fe (111). Initially, Cr atoms adsorbed on the Fe-top site of the MC carbide (010) crystal plane, maintaining a distance of 2.5 Å from the Fe atom. Notably, when the Cr atom doping amount was 0.5, the Cr–Fe metallic bond exhibited a long bond length, large bond angle and low bond strength in the MC transition state (TS), resulting in a reduced, reaction barrier (908.08 kcal/mol), thus promoting the precipitation of MC carbide in bearing steel. However, at a Cr atom doping amount level of 1, the shorter bond length, small bond angle, and higher bonding strength of the Cr–Fe metallic bond in the MC TS, elevated the reaction barrier (49709.72 kcal/mol), inhibiting the precipitation of MC carbide in bearing steel. Additionally, this study quantitatively analyzed the effect of Cr atom content on the brittle plastic properties and hardness of MC carbides. At Cr atom contents of 0.23 and 1, the MC carbide hardness reached a minimum value of 3.0 GPa and a maximum value of 17.1 GPa, respectively. This investigation not only elucidated the atomic scale effects of Cr interfacial segregation on the precipitation mechanism and mechanical properties of MC carbides but also provided new ideas for controlling carbide precipitation in high-carbon chromium bearing steels.

Keywords

• Bearing steel
• Carbide
• First principle
• Transition state
• Precipitation
• Cr atom