First Principles Studies on Structural, Elastic, Electronic, Optical Properties of MgSrPb and MgSrSi Half Heusler Alloys
- 13 January 2025
- journal article
- research article
- Published by Springer Nature in Journal of Inorganic and Organometallic Polymers and Materials
- p. 1-13
Abstract
No abstract availableKeywords
This publication has 83 references indexed in Scilit:
- First principles insight into the study of the structural, stability, and optoelectronic properties of alkali‐based single halide perovskite ZSnCl3 (Z = Na/K) materials for photovoltaic applicationsJournal of Computational Chemistry, 2024
- First principle studies on structural, electronic, elastic, optical, and thermoelectric properties of XGeCl3 (X = Rb/Cs): Promising compounds for green energy applicationInternational Journal of Quantum Chemistry, 2024
- Toward Sustainable Ultrawide Bandgap van der Waals Materials: An ab initio Screening EffortAdvanced Functional Materials, 2023
- Study of mechanical, optical, and thermoelectric characteristics ofBa2XMoO6(X = Zn, Cd) double perovskite for energy harvestingJournal of Computational Chemistry, 2023
- Enhancing the Thermoelectric Properties via Modulation of Defects in P‐Type MNiSn‐Based (M = Hf, Zr, Ti) Half‐Heusler MaterialsAdvanced Functional Materials, 2023
- First Principles Study of New d0 Half-Metallic Ferromagnetism in CsBaC Ternary Half-Heusler AlloyJournal of Superconductivity and Novel Magnetism, 2022
- Investigation of the Structural, Elastic, Electronic, and Optical Properties of Half-Heusler CaMgZ (Z = C, Si, Ge, Sn, Pb) CompoundsJournal of Electronic Materials, 2022
- Half-metallic ferromagnetic behavior of cubic lanthanide based on perovskite-type oxide NdCrO3: first-principles calculationsIndian Journal of Physics, 2021
- The Role of Goldschmidt’s Tolerance Factor in the Formation of A2BX6 Double Halide Perovskites and its Optimal RangeSmall Methods, 2019
- Structural, electronic, elastic, optical, and vibrational properties of HfXSb (X = Co, Rh, Ru) half-Heusler compounds: an ab initio studyIndian Journal of Physics, 2016