Manipulation of magnetocaloric and elastocaloric effects in Ni-Mn-In alloys by lattice volume and magnetic variation: Effect of Co and Fe co-doping

doi:10.1016/j.jmst.2023.06.044

Abstract

Abstract: The effects of Co and Fe co-doping Ni-Mn-In alloy on the phase stability, lattice parameters, magnetic properties, and electronic structures are systematically investigated by using the first-principles calculations. Results indicate that Fe atoms replace the excess Mn2 atoms by direct and indirect coexistence (Fe→Mn₂ and Fe→In→Mn2); Co substitutes the Ni atoms by direct substitution (Co→Ni) for the Ni-Mn-In alloy. The austenites all exhibit the ferromagnetic (FM) state for the studied compositions. The NM martensites are in the ferrimagnetic (FIM-1) state for the Ni₂Mn_1.5In_0.5, Ni₂Mn_1.25In_0.5Fe_0.25, Ni_1.75Mn_1.5In_0.5Co_0.25, and Ni_1.75Mn_1.25In_0.5Co_0.25Fe_0.25 alloys, while the other compositions are in the FM state. The phase stability of austenite and martensite decreases with increasing Co and Fe co-doping. A magnetic-structural coupling transition occurs at x < 0.25 and y < 0.25. The Ni_1.91Mn_1.5In_0.5Co_0.08 and Ni_1.91Mn_1.42In_0.5Co_0.08Fe_0.08 alloys exhibit an A→6M→NM transformation, accompanied by a magnetic transition. When Co and Fe are co-doped, the hybridization strength between Co and Fe is greater than that between Co/Fe and Mn. The enhancement of magnetocaloric and elastocaloric effects is favored by larger magnetization difference (∆M) and lattice volume change (∆V/V₀). Based on the calculated phase stability, magneto-structure coupling, ∆V/V₀ and c/a ratio, one can predict that the Ni_2-_xMn_1.5-_yIn_0.5Co_xFe_y alloy with Co content 0 ≤ x ≤ 0.25 and Fe content 0 ≤ y ≤ 0.05 is predicted to have good magneto-controlled functional behavior.

Key words: Ni-Mn-In-Co-Fe, Phase stability, Magnetocaloric effect, Elastocaloric effect

Xinzeng Liang, Chi Zhang, Jing Bai, Jianglong Gu, Yudong Zhang, Claude Esling, Xiang Zhao, Liang Zuo. Manipulation of magnetocaloric and elastocaloric effects in Ni-Mn-In alloys by lattice volume and magnetic variation: Effect of Co and Fe co-doping[J]. J. Mater. Sci. Technol., 2024, 172: 156-165.

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