Rana M. Elkhneny , Mohammed Said Mohammed Abu-Elmagd , Samy H. Aly , Sherif Yehia , Fatema Z. Mohammad
{"title":"Ho2Co17的磁相变和磁热效应:磁体积耦合的平均场研究","authors":"Rana M. Elkhneny , Mohammed Said Mohammed Abu-Elmagd , Samy H. Aly , Sherif Yehia , Fatema Z. Mohammad","doi":"10.1016/j.jmmm.2025.173206","DOIUrl":null,"url":null,"abstract":"<div><div>In this work, we present a theoretical study on the magnetic, magnetocaloric properties and the nature of phase transitions in Ho<sub>2</sub>Co<sub>17</sub> compound. We have used the mean- field Bean- Rodbell model, with taking into account the magneto-volume coupling, in our calculation. The temperature and magnetic field-dependences of the magnetization, heat capacity, entropy, isothermal change in entropy ΔS<sub>m</sub>, adiabatic temperature change ΔT<sub>ad</sub> and the relative cooling powers are reported. An interesting feature of a first-order phase transition (FOPT), around 650 K, followed by a second order (SOPT) one at the Curie temperature is reported. We have used the direct subtraction method, of the entropies at different fields, to calculate of both ΔS<sub>m</sub> and ΔT<sub>ad</sub>. The maximum ΔS<sub>m</sub> values, for a 5 T field change, are around 5.98 J/mol. K and 0.15 J/mol. K at the FOPT and the SOPT respectively. At the FOPT the adiabatic temperature change is around 8.7 K for a 5 T field change. In order to calculate the adiabatic change in temperature, the electronic and lattice contributions to the total heat capacity must be determined. These two quantities are dependent on the electronic density of states and Debye temperature respectively. For this purpose, we performed calculation on the elastic constants C<sub>ij</sub>, elastic moduli, and the electronic density of states (DOS) using the VASP code. For example, the Voigt bulk and shear moduli, and the Debye temperature are found to be 85.518 and 55.23 GPa, and 346.80 K respectively.</div></div>","PeriodicalId":366,"journal":{"name":"Journal of Magnetism and Magnetic Materials","volume":"628 ","pages":"Article 173206"},"PeriodicalIF":2.5000,"publicationDate":"2025-05-17","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Magnetic phase transitions and magnetocaloric effect in Ho2Co17: A mean-field with Magneto-Voulme coupling study\",\"authors\":\"Rana M. Elkhneny , Mohammed Said Mohammed Abu-Elmagd , Samy H. Aly , Sherif Yehia , Fatema Z. Mohammad\",\"doi\":\"10.1016/j.jmmm.2025.173206\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>In this work, we present a theoretical study on the magnetic, magnetocaloric properties and the nature of phase transitions in Ho<sub>2</sub>Co<sub>17</sub> compound. We have used the mean- field Bean- Rodbell model, with taking into account the magneto-volume coupling, in our calculation. The temperature and magnetic field-dependences of the magnetization, heat capacity, entropy, isothermal change in entropy ΔS<sub>m</sub>, adiabatic temperature change ΔT<sub>ad</sub> and the relative cooling powers are reported. An interesting feature of a first-order phase transition (FOPT), around 650 K, followed by a second order (SOPT) one at the Curie temperature is reported. We have used the direct subtraction method, of the entropies at different fields, to calculate of both ΔS<sub>m</sub> and ΔT<sub>ad</sub>. The maximum ΔS<sub>m</sub> values, for a 5 T field change, are around 5.98 J/mol. K and 0.15 J/mol. K at the FOPT and the SOPT respectively. At the FOPT the adiabatic temperature change is around 8.7 K for a 5 T field change. In order to calculate the adiabatic change in temperature, the electronic and lattice contributions to the total heat capacity must be determined. These two quantities are dependent on the electronic density of states and Debye temperature respectively. For this purpose, we performed calculation on the elastic constants C<sub>ij</sub>, elastic moduli, and the electronic density of states (DOS) using the VASP code. For example, the Voigt bulk and shear moduli, and the Debye temperature are found to be 85.518 and 55.23 GPa, and 346.80 K respectively.</div></div>\",\"PeriodicalId\":366,\"journal\":{\"name\":\"Journal of Magnetism and Magnetic Materials\",\"volume\":\"628 \",\"pages\":\"Article 173206\"},\"PeriodicalIF\":2.5000,\"publicationDate\":\"2025-05-17\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Magnetism and Magnetic Materials\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S030488532500438X\",\"RegionNum\":3,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"MATERIALS SCIENCE, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Magnetism and Magnetic Materials","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S030488532500438X","RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"MATERIALS SCIENCE, MULTIDISCIPLINARY","Score":null,"Total":0}
Magnetic phase transitions and magnetocaloric effect in Ho2Co17: A mean-field with Magneto-Voulme coupling study
In this work, we present a theoretical study on the magnetic, magnetocaloric properties and the nature of phase transitions in Ho2Co17 compound. We have used the mean- field Bean- Rodbell model, with taking into account the magneto-volume coupling, in our calculation. The temperature and magnetic field-dependences of the magnetization, heat capacity, entropy, isothermal change in entropy ΔSm, adiabatic temperature change ΔTad and the relative cooling powers are reported. An interesting feature of a first-order phase transition (FOPT), around 650 K, followed by a second order (SOPT) one at the Curie temperature is reported. We have used the direct subtraction method, of the entropies at different fields, to calculate of both ΔSm and ΔTad. The maximum ΔSm values, for a 5 T field change, are around 5.98 J/mol. K and 0.15 J/mol. K at the FOPT and the SOPT respectively. At the FOPT the adiabatic temperature change is around 8.7 K for a 5 T field change. In order to calculate the adiabatic change in temperature, the electronic and lattice contributions to the total heat capacity must be determined. These two quantities are dependent on the electronic density of states and Debye temperature respectively. For this purpose, we performed calculation on the elastic constants Cij, elastic moduli, and the electronic density of states (DOS) using the VASP code. For example, the Voigt bulk and shear moduli, and the Debye temperature are found to be 85.518 and 55.23 GPa, and 346.80 K respectively.
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The Journal of Magnetism and Magnetic Materials provides an important forum for the disclosure and discussion of original contributions covering the whole spectrum of topics, from basic magnetism to the technology and applications of magnetic materials. The journal encourages greater interaction between the basic and applied sub-disciplines of magnetism with comprehensive review articles, in addition to full-length contributions. In addition, other categories of contributions are welcome, including Critical Focused issues, Current Perspectives and Outreach to the General Public.
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