• Complex
  • Title
  • Keyword
  • Abstract
  • Scholars
  • Journal
  • ISSN
  • Conference
搜索

Author:

Zhang, F. (Zhang, F..) | Lu, Q. (Lu, Q..) | Li, H. (Li, H..) | Fang, H. (Fang, H..) | Liu, W. (Liu, W..) | Zhang, D. (Zhang, D..) | Yue, M. (Yue, M..)

Indexed by:

Scopus

Abstract:

Geometry, formation, electronic structure as well as magnetic properties of the tetragonal MnGa alloy were systematically studied by density functional theory method. The results show that the tetragonal MnGa has formation enthalpy of -4.85 eV, which is slightly higher than other compounds without d state electrons. It has conductor like band structure with the deep valance bands formed by d state electrons, they show strong localization effect. The tetragonal MnGa alloy shows obvious spin polarization. The s state electrons near Fermi energy and the p state electrons under Fermi energy have weak spin polarization, the d state electrons which form conductor band and bands below Fermi energy have strong spin polarization, they contribute to the total electronic as well as magnetic properties. The s and p state electrons of Mn have weak spin polarization, its d electrons which form conductor band and bands below Fermi energy have strongest spin polarization. The d electrons of Ga which form bands below Fermi energy have weak spin polarization. The two kinds of Ga have different spin polarization states. The tetragonal MnGa alloy has net magnetic moment, it shows weak ferrimagnetism. © 2022, Journal of Synthetic Crystals Press. All right reserved.

Keyword:

Magnetic material Magnetic property MnGa alloy Electronic structure Density functional theory method

Author Community:

  • [ 1 ] [Zhang F.]Henan Provincial Key Engineering Lab of Building-photovoltaics, Department of Mathematics and Physics, Henan University of Urban Construction, Pingdingshan, 467036, China
  • [ 2 ] [Lu Q.]Department of Materials and Manufacturing, Beijing University of Technology, Beijing, 100124, China
  • [ 3 ] [Li H.]Department of Materials and Manufacturing, Beijing University of Technology, Beijing, 100124, China
  • [ 4 ] [Fang H.]Academy of Physics and Electronic Engineering, Guangxi Normal University for Nationalities, Chongzuo, 532200, China
  • [ 5 ] [Liu W.]Department of Materials and Manufacturing, Beijing University of Technology, Beijing, 100124, China
  • [ 6 ] [Zhang D.]Department of Materials and Manufacturing, Beijing University of Technology, Beijing, 100124, China
  • [ 7 ] [Yue M.]Department of Materials and Manufacturing, Beijing University of Technology, Beijing, 100124, China

Reprint Author's Address:

Email:

Show more details

Related Keywords:

Source :

Journal of Synthetic Crystals

ISSN: 1000-985X

Year: 2022

Issue: 1

Volume: 51

Page: 65-71

Cited Count:

WoS CC Cited Count: 0

SCOPUS Cited Count:

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 10

Affiliated Colleges:

Online/Total:1444/10611736
Address:BJUT Library(100 Pingleyuan,Chaoyang District,Beijing 100124, China Post Code:100124) Contact Us:010-67392185
Copyright:BJUT Library Technical Support:Beijing Aegean Software Co., Ltd.