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Philosophical Magazine Volume 100, 2020 - Issue 12
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Part B: Condensed Matter Physics

Structural, electronic, magnetic and thermoelectric properties of inverse Heusler alloys Ti2CoSi, Mn2CoAl and Cr2ZnSi by employing Ab initio calculations

D. J. Mokhtaria Faculty of Science, Department of Physics, University of M’sila, M’sila, Algeria;b Laboratory of Physics and Chemistry of Materials, University of M’sila, M’sila, Algeria
,
Inshad Jum’hc School of Basic Science and Humanities, German-Jordanian University (GJU), Amman, Jordan
,
H. Baaziza Faculty of Science, Department of Physics, University of M’sila, M’sila, Algeria;b Laboratory of Physics and Chemistry of Materials, University of M’sila, M’sila, AlgeriaCorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0003-4860-2740
ORCID Icon,
Z. Charifia Faculty of Science, Department of Physics, University of M’sila, M’sila, Algeria;b Laboratory of Physics and Chemistry of Materials, University of M’sila, M’sila, Algeria
,
T. Ghellaba Faculty of Science, Department of Physics, University of M’sila, M’sila, Algeria;b Laboratory of Physics and Chemistry of Materials, University of M’sila, M’sila, Algeria
,
Ahmad Telfahd Leibniz-Institut fürAnalytischeWissenschaften – ISAS – e.V, Dortmund, Germany
&
Roland Hergenröderd Leibniz-Institut fürAnalytischeWissenschaften – ISAS – e.V, Dortmund, Germany
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Pages 1636-1661 | Received 14 Sep 2019, Accepted 10 Feb 2020, Published online: 24 Feb 2020

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R. Meenakshi, R. Aram Senthil Srinivasan, A. Amudhavalli, R. Rajeswarapalanichamy & K. Iyakutti. (2021) Electronic structure, magnetic, optical and transport properties of half-Heusler alloys RhFeZ(Z = P, As, Sb, Sn, Si, Ge, Ga, In, Al) – a DFT study. Phase Transitions 94:6-8, pages 415-435.
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Articles from other publishers (14)

Shubha Dubey, Jisha A. Abraham, Kumud Dubey, Vineet Sahu, Anchit Modi, G. Pagare & N.K. Gaur. (2024) DFT study of RhTiP half Heusler semiconductor: Revealing its mechanical, optoelectronic, and thermoelectric properties. Physica B: Condensed Matter 672, pages 415452.
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Edward Tindibale, Winfred M. Mulwa & Bamidele I. Adetunji. (2023) Elastic, anisotropic, lattice dynamics and electronic properties of XNiM and XNi2M (X = Ti, Zr, Hf; M = Sn, Ge, Si): DFT comparison study. Physica B: Condensed Matter 665, pages 415029.
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E. I. Shreder, A. N. Filanovich, E. D. Chernov, A. V. Lukoyanov, V. V. Marchenkov & L. A. Stashkova. (2023) The Electronic Structure, Thermoelectric, and Optical Properties of Heusler Alloys Mn2MeAl (Me = Ti, V, Cr). Physics of Metals and Metallography 124:7, pages 684-691.
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P. Rambabu, Anusree C.V.M. Manivel Raja & V. Kanchana. (2022) Anomalous transverse effects in nodal line compounds Co TaX (X = Al, Ga) . Journal of Magnetism and Magnetic Materials 562, pages 169766.
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Altaf Ur Rahman, Asif Jamil, Sajid Khan, Muhammad Ibrar, Imran Ullah, Rashid Ahmad & Alaa Dahshan. (2022) First-Principles Computational Exploration of Thermoelectric Properties of Bulk-GaN and Monolayer-GaN. Journal of Electronic Materials 51:6, pages 3317-3328.
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Lalrinkima, Lalthakimi Zadeng, Lalmuan Chhana, Lalhriat Zuala & D.P. Rai. (2022) Surface half metallicity and thermodynamic stability of 001-plane Ti2XSi (X=Mn, Co) Heusler alloys (HAs): A DFT approach. Surfaces and Interfaces 28, pages 101602.
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G. Remil, A. Zitouni, B. Bouadjemi, M. Houari, A. Abbad, W. Benstaali, S. Cherid, M. Matougui, T. Lantri & S. Bentata. (2021) A potential full Heusler thermoelectric material CO2ZrZ (Z=Al, Si, Ga and Sn) in low temperature: An Ab-initio investigation. Solid State Communications 336, pages 114422.
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Mohamed Hichem Elahmar, Habib Rached & Djamel Rached. (2021) The half metallic feature at high temperature of the novel half-Heusler alloys and their [100] oriented layered superlattices: A DFT investigations. Materials Chemistry and Physics 267, pages 124712.
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Vipul Srivastava, Navdeep Kaur, Xiaotian Wang, Muhammad Mushtaq & Sajad Ahmad Dar. (2021) First‐principles study on structural, electronic, magnetic, elastic, mechanical and thermodynamic properties of Mn 2 PtCo Heusler alloy . International Journal of Energy Research 45:7, pages 11305-11319.
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Emre Güler, Melek Güler, Şule Uğur & Gökay Uğur. (2021) First principles study of electronic, elastic, optical and magnetic properties of Rh 2 MnX (X = Ti, Hf, Sc, Zr, Zn) Heusler alloys . International Journal of Quantum Chemistry 121:10.
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Hezhang Li, Kei Hayashi, Yoshimi Nagashima, Shun Yoshioka, Jinfeng Dong, Jing-Feng Li & Yuzuru Miyazaki. (2021) Effects of Disorder on the Electronic Structure and Thermoelectric Properties of an Inverse Full-Heusler Mn 2 CoAl Alloy . Chemistry of Materials 33:7, pages 2543-2547.
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Ş. Uğur, M. Güler, G. Uğur & E. Güler. (2021) Elastic, mechanical, optical and magnetic properties of Ru2MnX (X = Nb, Ta, V) Heusler alloys. Journal of Magnetism and Magnetic Materials 523, pages 167614.
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M Güler, E Güler, Ş Uğur, G Uğur, Z Charifi & H Baaziz. (2021) Elastic, mechanical, anisotropic, optical and magnetic properties of V 2 NiSb Heusler alloy . Physica Scripta 96:3, pages 035807.
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M Zafar, Swera Amjad, M Shakil, S S A Gillani, Hafsa Arshad, M B Tahir & N H Tariq. (2021) Determination of structural, mechanical, thermal and magnetic properties of Cr based new quaternary Heusler alloys with GGA and GGA+U. Physica Scripta 96:3, pages 035701.
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