Energy Spectrum and Optical Absorption of Mn100 – хAlх (x = 20, 30) Compounds with the β-Mn Structure

Мұқаба

Дәйексөз келтіру

Толық мәтін

Ашық рұқсат Ашық рұқсат
Рұқсат жабық Рұқсат берілді
Рұқсат жабық Тек жазылушылар үшін

Аннотация

This paper presents electronic spectrum calculations and a study of the optical properties of the binary compounds Mn70Al30 and Mn80Al20 with the β-Mn structure. The energy dependences of the calculated density of states, with high values at the Fermi level, are determined by broad bands formed by manganese 3d states. The calculated electronic structures are used to analyze measured optical conductivity spectra of the alloys in the quantum light absorption range. From their optical properties in the infrared spectral region, we evaluate a number of characteristics of conduction electrons.

Авторлар туралы

Yu. Knyazev

Mikheev Institute of Metal Physics, Ural Branch, Russian Academy of Sciences, 620108, Yekaterinburg, Russia

Email: knyazev@imp.uran.ru
Россия, 620108, Екатеринбург, ул. С. Ковалевской, 18

A. Lukoyanov

Mikheev Institute of Metal Physics, Ural Branch, Russian Academy of Sciences, 620108, Yekaterinburg, Russia; Yeltsin Federal University, 620002, Yekaterinburg, Russia

Email: knyazev@imp.uran.ru
Россия, 620108, Екатеринбург, ул. С. Ковалевской, 18; Россия, 620002, Екатеринбург, ул. Мира, 19

Yu. Knyazev

Mikheev Institute of Metal Physics, Ural Branch, Russian Academy of Sciences, 620108, Yekaterinburg, Russia

Email: knyazev@imp.uran.ru
Россия, 620108, Екатеринбург, ул. С. Ковалевской, 18

Shubhra Dash

Central University of Rajasthan, NH-8, Rajasthan, 305817, Bandarsindri, India; MLR Institute of Technology, Dundigal, Telangana, 500043, Hyderabad, India

Email: knyazev@imp.uran.ru
Индия, 305817, Раджастан, Бандарсиндри; Индия, Телангана, Хайдарабад-500043

Ajit Patra

Central University of Rajasthan, NH-8, Rajasthan, 305817, Bandarsindri, India

Email: knyazev@imp.uran.ru
Индия, 305817, Раджастан, Бандарсиндри

M. Vasundhara

Polymers and Functional Materials Department, CSIR–Indian Institute of Chemical Technology, Telangana, 500007, Tarnaka, Hyderabad, India

Хат алмасуға жауапты Автор.
Email: knyazev@imp.uran.ru
Индия, 500007, Телангана, Хайдарабад

Әдебиет тізімі

  1. Elphick K., Frost W., Samiepour M., Kubota T., Takanashi K., Sukegawa H., Mitani S., Hirohata A. Heusler Alloys for Spintronic Devices: Review on Recent Development and Future Perspectives // Sci. Technol. Adv. Mater. 2021. V. 22. № 1. P. 235–271. https://doi.org/10.1080/14686996.2020.1812364
  2. Jiang S., Yang K. Review of High-Throughput Computational Design of Heusler Alloys // J. Alloys Compd. 2021. V. 867. P. 158854-1–158854-14. https://doi.org/10.1016/j.jallcom.2021.158854
  3. Katsnelson M.I., Irkhin V.Yu., Chioncel L., Lichtenstein A.I., de Groot R.A. Half-Metallic Ferromagnets: From Band Structure to Many-body Effects // Rev. Mod. Phys. 2008. V. 80. № 2. P. 315–378. https://doi.org/10.1103/RevModPhys.80.315
  4. Wollmann L., Chadov S., Kübler J., Felser C. Magnetism in Cubic Manganese-Rich Heusler Compounds // Phys. Rev. B. 2014. V. 90. № 21. P. 214420-1–214420-11. https://doi.org/10.1103/PhysRevB.90.214420
  5. Li T., Khenata R., Cheng Z., Chen H., Yuan H., Yang T., Kuang M., Omran S.B., Wang X. Martensitic Transformation, Electronic Structure and Magnetism in D03-Ordered Heusler Mn3Z (Z = B, Al, Ga, Ge, Sb) Alloys // Acta Crystallogr., Sect. B. 2018. V. 74. P. 673–680. https://doi.org/10.1107/S2052520618013525
  6. Skomski R. Finite-Temperature Depolarization in Half Metals // J. Phys.: Condens. Matter. 2007. V. 19. № 31. P. 315202-1–315202-14. https://doi.org/10.1088/0953-8984/19/31/315202
  7. Alling B., Shallcross S., Abrikosov I.A. Role of Stoichiometric and Nonstoichiometric Defects on the Magnetic Properties of the Half-metallic Ferromagnet NiMnSb // Phys. Rev. B. 2006. V. 73. № 6. P. 064418-1–064418-9. https://doi.org/10.1103/PhysRevB.73.064418
  8. Gavrikov I., Seredina M., Zheleznyy M., Shchetinin I., Karpenkov D., Bogach A., Chatterjee R., Khovaylo V. Magnetic and Transport Properties of Mn2FeAl // J. Magn. Magn. Mater. 2019. V. 478. № 1. P. 55–58. https://doi.org/10.1016/j.jmmm.2019.01.088
  9. Gao G.Y., Yao K.-L. Antiferromagnetic Half-metals, Gapless Half-metals, and Spin Gapless Semiconductors:The D03-type Heusler Alloys // Appl. Phys. Lett. 2013. V. 103. № 23. P. 232409-1–232409-5. https://doi.org/10.1063/1.4840318
  10. Azar S.M., Hamad B.A., Khalifeh J.M. Structural, Electronic and Magnetic Properties of Fe3–xMnxZ (Z = Al, Ge, Sb) Heusler Alloys // J. Magn. Magn. Mater. 2012. V. 324. № 10. P. 1776–1785. https://doi.org/10.1016/j.jmmm.2011.12.037
  11. Han J., Wu X., Feng Y., Gao G. Half-Metallic Fully Compensated Ferrimagnetism and Multifunctional Spin Transport Properties of Mn3Al // J. Phys.: Condens. Matter. 2019. V. 31. № 30. P. 305501-1–305501-9. https://doi.org/10.1088/1361-648X/ab1732
  12. Jum′h I., Sâad essaoud S., Baaziz H., Charifi Z., Telfah A. Electronic and Magnetic Structure and Elastic and Thermal Properties of Mn2-Based Full Heusler Alloys // J. Supercond. Nov. Magn. 2019. V. 32. P. 3915–3926. https://doi.org/10.1007/s10948-019-5095-3
  13. Li Q.F., Yang C.H., Su J.L. Effect of Doping V on the Half-Metallic and Magnetic Properties of Mn3Al Intermetallic Compound // Physica B: Condens. Matter. 2011. V. 406. № 19. P. 3726–3730. https://doi.org/10.1016/j.physb.2011.07.003
  14. Jamer M.E., Wang Y.J., Stephen G.M., McDonald I.J., Grutter A.J., Sterbinsky G.E., Arena D.A., Borchers J.A., Kirby B.J., Lewis L.H., Barbiellini B., Bansil A., Heiman D. Compensated Ferrimagnetism in the Zero-moment Heusler Alloy Mn3Al // Phys. Rev. Appl. 2017. V. 7. № 6. P. 064036-1–064036-7. https://doi.org/10.1103/PhysRevApplied.7.064036
  15. Paddison J.A.M., Stewart J.R., Manuel P., Courtois P., McIntyre G.J., Rainford B.D., Goodwin A.L. Emergent Frustration in Co-Doped β-Mn // Phys. Rev. Lett. 2013. V. 110. № 26. P. 267207-1–267207-5. https://doi.org/10.1103/PhysRevLett.110.267207
  16. Dash S., Lukoyanov A.V., Nancy, Mishra D., Rasi U.P.M., Gangineni R.B., Vasundhara M., Patra A.K. Structural Stability and Magnetic Properties of Mn2FeAl Alloy with a β-Mn Structure // J. Magn. Magn. Mater. 2020. V. 513. P. 167205-1–167205-9. https://doi.org/10.1016/j.jmmm.2020.167205
  17. Марченков В.В., Ирхин В.Ю., Перевозчикова Ю.А., Терентьев П.Б., Семянникова А.А., Марченкова Е.Б., Эйстерер М. Кинетические свойства и полуметаллический магнетизм в сплавах Гейслера Mn2YAl // ЖЭТФ. 2019. Т. 155. № 6. С. 1083–1090. https://doi.org/10.1134/S0044451019060129
  18. Giannozzi P., Baroni S., Bonini N., Calandra M., Car R., Cavazzoni C., Ceresoli D., Chiarotti G.L., Cococcioni M., Dabo I., Dal Corso A., de Gironcoli S., Fabris S., Fratesi G., Gebauer R., Gerstmann U., Gougoussis C., Kokalj A., Lazzeri M., Martin-Samos L., Marzari N., Mauri F., Mazzarello R., Paolini S., Pasquarello A., Paulatto L., Sbraccia C., Scandolo S., Sclauzero G., Seitsonen A.P., Smogunov A., Umari P., Wentzcovitch R.M. QUANTUM ESPRESSO: a Modular and Open-Source Software Project for Quantum Simulations of Materials // J. Phys.: Condens. Matter. 2009. V. 21. № 39. P. 395502-1–395502-19. https://doi.org/10.1088/0953-8984/21/39/395502
  19. Яржемский В.Г., Мурашов С.В., Изотов А.Д. Электронное строение и температура ферромагнитного перехода Ga1 – xMnxAs в неэмпирическом методе локального обмена // Неорган. материалы. 2019. Т. 55. № 1. С. 3–10. https://doi.org/10.1134/S0002337X19010184
  20. Яржемский В.Г., Мурашов С.В., Изотов А.Д. Электронное строение и обменное взаимодействие в магнитных полупроводниках Ga1-xMnxAs и In1-xMnxSb // Неорган. материалы. 2016. Т. 52. № 2. С. 119–123. https://doi.org/10.7868/S0002337X16020172
  21. Яржемский В.Г., Мурашов С.В., Изотов А.Д. Расчет электронного строения и обменного взаимодействия в полупроводниках InSb и GaAs при солегировании Mn и Ni // Неорган. материалы. 2017. Т. 53. № 11. С. 1158–1162. https://doi.org/10.7868/S0002337X17110057
  22. Perdew J.P., Burke K., Ernzerhof M. Generalized Gradient Approximation Made Simple // Phys. Rev. Lett. 1996. V. 77. № 18. P. 3865–3868. https://doi.org/10.1103/PhysRevLett.77.3865
  23. Носков М.М. Оптические и магнетооптические свойства металлов Свердловск: УНЦ АН СССР, 1983. С. 220.

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© Ю.В. Князев, А.В. Лукоянов, Ю.И. Кузьмин, Shubhra Dash, Ajit K. Patra, M. Vasundhara, 2023