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Author:

Mao Fei (Mao Fei.) | Tang Fawei (Tang Fawei.) | Lv Hao (Lv Hao.) | Guo Kai (Guo Kai.) | Liu Dong (Liu Dong.) | Song Xiaoyan (Song Xiaoyan.) (Scholars:宋晓艳)

Indexed by:

EI SCIE

Abstract:

In this work, A first-principles calculation model of SmCo5 alloy with main group elements doping was established. Taking Al, Ga, In, and Sn as examples, the influence of intrinsic characteristics of doping elements, doping concentration and temperature on the phase stability and magnetic properties of SmCo5 alloy was studied. The calculation result indicate that the physical and chemical properties of doped main group elements and the size of the vacant space in the doping systems are two main factors that influence the occupation site of the doping elements. Al and Ga are beneficial to the stability of SmCo5 system. Moreover, the occupation sites probability of Al varies insignificantly with temperature, which indicates that the SmCo5 system doped with Al may be applied in applications with a wide temperature range. Regarding to the magnetic properties, the SmCo5 system doped with In has a relatively high magnetic moment, although the total magnetic moment of the SmCo5 system always decreases with the addition of the studied main group elements. The main reason is that In has a relatively large atomic radius, which may induce lattice distortion and result in the increase of magnetic moment between Co atoms. Therefore, the decrease of the total magnetic moment of the doping system can be compensated. Based on the above calculations, Al and In are selected as the candidate elements which are beneficial to the stability and magnetic properties of SmCo5 based alloys. Moreover, the optimal doping concentration ranges of Al and In were predicted.

Keyword:

Sm-Co-based permanent magnetic alloy structural stability element doping first-principles calculations magnetic moment

Author Community:

  • [ 1 ] [Mao Fei]Beijing Univ Technol, Fac Mat & Mfg, Key Lab Adv Funct Mat, Minist Educ, Beijing 100124, Peoples R China
  • [ 2 ] [Tang Fawei]Beijing Univ Technol, Fac Mat & Mfg, Key Lab Adv Funct Mat, Minist Educ, Beijing 100124, Peoples R China
  • [ 3 ] [Lv Hao]Beijing Univ Technol, Fac Mat & Mfg, Key Lab Adv Funct Mat, Minist Educ, Beijing 100124, Peoples R China
  • [ 4 ] [Guo Kai]Beijing Univ Technol, Fac Mat & Mfg, Key Lab Adv Funct Mat, Minist Educ, Beijing 100124, Peoples R China
  • [ 5 ] [Liu Dong]Beijing Univ Technol, Fac Mat & Mfg, Key Lab Adv Funct Mat, Minist Educ, Beijing 100124, Peoples R China
  • [ 6 ] [Song Xiaoyan]Beijing Univ Technol, Fac Mat & Mfg, Key Lab Adv Funct Mat, Minist Educ, Beijing 100124, Peoples R China

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Source :

RARE METAL MATERIALS AND ENGINEERING

ISSN: 1002-185X

Year: 2022

Issue: 2

Volume: 51

Page: 535-544

0 . 7

JCR@2022

0 . 7 0 0

JCR@2022

ESI Discipline: MATERIALS SCIENCE;

ESI HC Threshold:66

JCR Journal Grade:4

CAS Journal Grade:4

Cited Count:

WoS CC Cited Count: 2

SCOPUS Cited Count:

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 4

Affiliated Colleges:

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