Effect of Pressure on Elastic Constants and Related Properties of Rare-Earth Intermetallic Compound TbNiAl
Source abstract
Abstract
Abstract The Lennard-Jones potential approach is used to investigate the effect of pressure on the ultrasonic and elastic properties of the rare-earth ternary TbNiAl intermetallic compound. The second- and third-order elastic constants of TbNiAl are considered using the potential model. The pressure-dependent higher-order elastic constants are studied, and it is observed that the elastic constants of the TbNiAl compound increased monotonously with pressure. The hexagonal TbNiAl compound is mechanically stable up to the pressure 20 GPa according to the Born elastic stability criteria. The Voigt–Reuss–Hill approach is used to compute such elastic parameters as Young’s modulus, bulk modulus, Poisson’s ratio, and shear modulus in the pressure range 0–45 GPa. Hardness, melting temperature, and anisotropy are also determined for the intermetallic TbNiAl compound. The pressure-dependent velocities and attenuation of ultrasonic waves in this ternary compound are evaluated. The computation results are also satisfactory in estimating the Debye temperature and thermal conductivity Kmin under different pressure. It is observed that TbNiAl has a significant anisotropy at zero pressure, which becomes stronger as the pressure increased. This ternary compound behaves as its purest form at higher pressure and is more ductile, which is demonstrated by the minimum attenuation.
Source: openalex_inverted_index · Quality: baseline
Research context
OpenAlex topics: High-pressure geophysics and materials · Intermetallics and Advanced Alloy Properties · Boron and Carbon Nanomaterials Research
SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.
References (39)
Show source-provided references
1. Cable, J.W., Koehlar, W.C., and Wollan, E.O., Magnetic Order in Rare-Earth Intermetallic Compound, Phys. Rev., 1964, vol. 136, pp. 240–242. https://doi.org/10.1103/PhysRev.136.A24010.1103/PhysRev.136.A240 ↗
2. Javorsky, P., Burlet, P., Shekovsky, P., Arons, R.R., Ressouche, E., and Lapertot, G., Neutron Diffraction Study of Magnetic Ordering in RNiAl Compounds, Phys. B. Condens. Matter, 1997, vol. 234, pp. 665–666. https://doi.org/10.1016/S0921-4526(96)01080-010.1016/S0921-4526(96)01080-0 ↗
3. Kitazawa, H., Donni, A., Keller, L., Tang, J., Fauth, F., and Kido, G., Magnetic Structures of the Rare-Earth Platinum Aluminides RPtAl (R = Ce, Pr, Nd), J. Solid Chem., 1998, vol. 140, pp. 233–241. https://doi.org/10.1006/jssc.1998.788110.1006/jssc.1998.7881 ↗
4. Soderberg, O., Brown, D., Aaltio, I., Oksanen, J., Syren, J., Pulkkinen, H., Hannula, S.P., Microstructure and Properties of Ni–Mn–Ga Alloys Produced by Rapid Solidification and Pulsed Electric Current Sintering, J. Alloys Compnd, 2011, vol. 509, pp. 5981–5987. https://doi.org/10.1016/j.jallcom.2011.02.1610.1016/j.jallcom.2011.02.16 ↗
5. Klicpera, M., Javorský, P., and Puente Orench, I., Development of Magnetic Order in the TbNi(Al, In) Series and Magnetocrystalline Anisotropy in TbTX Compounds, Phys. Rev. B, 2011, vol. 84, pp. 224414–8. https://doi.org/10.1103/PhysRevB.84.22441410.1103/PhysRevB.84.224414 ↗
6. Javorsky, P., Prchal, J., Klicpera, M., Kastil, J., and Misek, M., Pressure Influence on Magnetic Properties of TbNiAl, Acta Phys. Polon. A, 2014, vol. 126, pp. 280–281. https://doi.org/10.12693/APhysPolA.126.28010.12693/APhysPolA.126.280 ↗
7. Mao, H.K., Bell, P.M., Shaner, J.W., and Steinberg, D.J., Specific Volume Measurements of Cu, Mo, Pd, and Ag and Calibration of the Ruby R1 Fluorescence Pressure Gauge from 0.06 to 1 Mbar, J. Appl. Phys., 1978, vol. 49, pp. 3276–3282. https://doi.org/10.1063/1.32527710.1063/1.325277 ↗
8. Ishii, Y., Kosaka, M., Uwatoko, Y., Andreev, A.V., and Sechovský, V., Ferromagnetism Induced in UCoAl under Uniaxial Pressure, Phys. B. Condens. Matter, 2003, vol. 334, pp. 160–166. https://doi.org/10.1016/S0921-4526(03)00041-310.1016/S0921-4526(03)00041-3 ↗
9. Prchal, J., Javorsky, P., Rusz, J., de Boer, F., Divis, M., Kitazawa, H., Donni, A., Danis, S., and Sechovsky, V., Structural Discontinuity in the Hexagonal RtAl Compounds: Experiments and Density-Functional Theory Calculations, Phys. Rev. B, 2008, vol. 77, p. 134106. https://doi.org/10.1103/PhysRevB.77.13410610.1103/PhysRevB.77.134106 ↗
10. Prchal, J., Klicpera, M., Dolezal, P., Kastil, J., Misek, M., and Javorsky, P., Pressure Effect on the Isostructural Transition in RNiAl Compounds (R = Tb and Gd), J. Phys. Conf. Ser., 2014, vol. 500, p. 032013. https://doi.org/10.1088/1742-6596/500/3/03201310.1088/1742-6596/500/3/032013 ↗
11. Jha, A.R., Applications of Rare Earth Intermetallic Compounds, Hydrides, and Ceramics, New York: Taylor & Francis Group, 2014.
12. Singh, N.K., Suresh, K.G., Nirmala, R., Nigam, A.K., Malik, S.K., Magnetic and Magnetocaloric Properties of the Intermetallic Compound TbNiAl, J. Magnetism Magnetic Mater., 2006, vol. 302(2), pp. 302–305. https://doi.org/10.1016/j.jmmm.2005.09.02310.1016/j.jmmm.2005.09.023 ↗
13. Jaiswal, A.K., Yadawa, P.K., and Yadav, R.R., Ultrasonic Wave Propagation in Ternary Intermetallic CeCuGe Compound, Ultrasonics, 2018, vol. 89, pp. 22–25. https://doi.org/10.1016/j.ultras.2018.04.00910.1016/j.ultras.2018.04.009 ↗
14. Panday, D.K., Yadawa, P.K., and Yadav, R.R., Ultrasonic Properties of Hexagonal ZnS at Nanoscale, Mater. Lett. 2007, vol. 61, pp. 5194–5198. https://doi.org/10.1016/j.matlet.2007.04.02810.1016/j.matlet.2007.04.028 ↗
15. Yadawa, P.K., Singh, D., Panday, D.K., and Yadav, R.R., Elastic and Acoustic Properties of Heavy Rare-Earth Metals, Open Acoustics J., 2009, vol. 2, pp. 61–67. https://doi.org/10.2174/1874837600902010061 ↗
16. Donald, T.M. and Glen, A.S., High Lattice Thermal Conductivity Solids in High Thermal Conductivity of Materials, Springer, 2006, pp. 37–43.
17. Voigt, W., Lehrbuch der Kristallphysik (Mitausschluss der Kristalloptik), Leipzig–Berlin: B.G. Teubner, 1928.
18. Reuss, A., Berechnung der Fließgrenze von Mischkristallen auf Grund der Plastizitätsbedingung für Einkristalle, ZAMM–J. Appl. Math. Mech., 1929, vol. 9, p. 49. http://dx.doi.org/10.1002/zamm.1929009010410.1002/zamm.19290090104 ↗
19. Hill, R., The Elastic Behaviour of a Crystalline Aggregate, Proc. Phys. Soc. A, 1952, vol. 65, pp. 349–354. https://doi.org/10.1088/0370-1298/65/5/30710.1088/0370-1298/65/5/307 ↗
20. Turkdal, N., Deligoz, E., Ozisik, H., and Ozisik, H.V., First-Principles Studies of the Structural, Elastic, and Lattice Dynamical Properties of ZrMo2 and HfMo2, Phase Transit., 2017, vol. 90, pp. 1–12. https://doi.org/10.1080/01411594.2016.125297910.1080/01411594.2016.1252979 ↗
21. Weck, P.F., Kim, E., Tikare, V., and Mitchell, J.F., Mechanical Properties of Zirconium Alloys and Zirconium Hydrides Predicted from Density Functional Perturbation Theory, Dalton Trans., 2015, vol. 44, pp. 18769–18779. https://doi.org/10.1039/C5DT03403E10.1039/C5DT03403E ↗
22. Yadav, N., Singh, S.P., Maddheshiya, A.K., Yadawa, P.K., and Yadav, R.R., Mechanical and Thermophysical Properties of High-Temperature IrxRe1–x Alloys, Phase Transit., 2020, vol. 93, pp. 883–894. https://doi.org/10.1080/01411554.2020181329010.1080/01411554.20201813290 ↗
23. Singh, D., Panday, D.K., Yadawa, P.K., and Yadav, A.K., Attenuation of Ultrasonic Waves in V, Nb and Ta at Low Temperatures, Cryogen, 2009, vol. 49. pp. 12–16. https://doi.org/10.1016/j.cryogenics.2008.08.00810.1016/j.cryogenics.2008.08.008 ↗
24. Yadawa, P.K., Computational Study of Ultrasonic Parameters of Hexagonal Close-Packed Transition Metals Fe, Co, and Ni, Arab. J. Sci. Eng., 2012, vol. 37, pp. 255–262. https://doi.org/10.1007/s13369-011-0153-610.1007/s13369-011-0153-6 ↗
25. Pillai, S.O., Solid State Physics: Crystal Physics, New Age International Publisher, 2005, pp. 100–102.
26. Fine, M.E., Brown, L.D., and Marcus, H.L., Elastic Constants Versus Melting Temperature in Metals, Scripta Metallurg., 1984, vol. 18, pp. 951–956. https://doi.org/10.1016/0036-9748(84)90267-910.1016/0036-9748(84)90267-9 ↗
27. Panday, D.K. and Panday, S., Ultrasonics: A Technique of Material Characterization, Sciyo Croatia: Sciyo Publisher, 2010, pp. 397–430.
28. Yadawa, P.K., Elastic and Acoustic Properties of Hexagonal Intermetallic Ternary Compound, J. Pure Appl. Ultrasonics, 2018, vol. 40, pp. 16–21.
29. Rai, S., Chaurasiya, N., and Yadawa, P.K., Elastic, Mechanical and Thermophysical Properties of Single-Phase Quaternary ScTiZrHf High-Entropy Alloy, Phys. Chem. Solid State, 2021, vol. 22, pp. 687–696. https://doi.org/10.15330/pcss.22.4.687-69610.15330/pcss.22.4.687-696 ↗
30. Havela, L., Divis, M., Sechovsky, V., Andreev, A.V., Honda, F., Oomi, G., Meresse, F., and Heathman, S., U Ternaries with ZrNiAl Structure–Lattice Properties, J. Alloys Compnd, 2001, vol. 322, pp. 7–13. https://doi.org/10.1016/S0925-8388(01)01176-810.1016/S0925-8388(01)01176-8 ↗
31. Zhang, G., Zhao, Y.X., Hao, Y.J., and Zhang, L., Structural, Elastic, Electronic and Thermodynamic Properties of ZrB2 under High-Pressure: First-Principle Study, World Sci., 2018, vol. 32, pp. 1–15. https://doi.org/10.1142/S021797921850200410.1142/S0217979218502004 ↗
32. Suetin, T.V. and Shien, I.R., Electronic and Mechanical Properties, Phase Stability, and Formation Energies of Point Defects of Niobium Boronitride Nb2BN, Phys. Solid State, 2017, vol. 59, pp. 1459–1469. https://doi.org/10.1134/S106378341708028510.1134/S1063783417080285 ↗
33. Guechi, A., Merabet, A., Chegaar, M., Bouhemadou, A., and Guechi, N., Pressure Effect on the Structural, Elastic, Electronic and Optical Properties of the Zintl Phase KAsSn, First Principles Study, J. Alloys Compnd, 2015, vol. 623, pp. 219–228. https://doi.org/10.1016/j.jallcom.2014.10.11410.1016/j.jallcom.2014.10.114 ↗
34. Ranganathan, S.I. and Ostoja-Starzewski, M., Universal Elastic Anisotropy Index, Phys. Rev. Lett., 2008, vol. 101, pp. 1–4. https://doi.org/10.1103/PhysRevLett.101.05550410.1103/PhysRevLett.101.055504 ↗
35. Panda, K.B. and Ravi Chandran, K.S., Determination of Elastic Constants of Titanium Diboride (TiB2) from First Principles Using FLAPW Implementation of the Density Functional Theory, Comput. Mater. Sci., 2006, vol. 35, pp. 134–150. https://doi.org/10.1103/PhysRevLett.101.05550410.1103/PhysRevLett.101.055504 ↗
36. Yadawa, P.K., Ultrasonic Characterization of Ceramic Material Titanium Diboride, Ceramics-Silikaty, 2011, vol. 55, pp. 127–133.
37. Singh, S.P., Singh, G., Verma, A.K., Yadawa, P.K., and Yadav, R.R., Ultrasonic Wave Propagation in Thermoelectric ZrX2 (X = S, Se) Compounds, Pramana. J. Phys., 2019, vol. 93, pp. 1–9. https://doi.org/10.1007/s12043-019-1846-810.1007/s12043-019-1846-8 ↗
38. Yadawa, P.K., Behaviour of Ultrasonic Velocities and Elastic Constants in Ag-Zn Alloys, Adv. Mater. Lett., 2011, vol. 2, pp. 157–162. https://doi.org/10.5185/amlett.2010.12190 ↗
39. Yadawa, P.K., Effect of Temperature Dependence Ultrasonic Velocities and Attenuation of GaP Nanowires, J. Theor. Appl. Phys., 2016, vol. 10, pp. 1–7. https://doi.org/10.1007/s40094-016-0216-x10.1007/s40094-016-0216-x ↗