First principles calculations to investigate electronic, magnetic anisotropy energy and optical properties of MnCrP half-Heusler alloy

First principles calculations to investigate electronic, magnetic anisotropy energy and optical properties of MnCrP half-Heusler alloy

In this current research work, the electronic, magnetic and optical properties of half Heusler alloy MnCrP are calculated and discussed within DFT framework. These calculations are done by using Wien2k code with Perdew–Burke–Ernzerhof Generalized Gradient Approximation and Tran-Blaha modified Becke-...

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Bibliographic Details
Main Authors: Ayash O. Alrashdi, Anila Asif, Mohammed M. Fadhali, Abu Bakar, A. Afaq, Jehan Alqahtani
Format: Article
Language:English
Published: Elsevier 2022-09-01
Series:Journal of Materials Research and Technology
Subjects:
Optical
Band structures
Magnetic anisotropy energy
DOS
Online Access:http://www.sciencedirect.com/science/article/pii/S2238785422013825

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http://www.sciencedirect.com/science/article/pii/S2238785422013825

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