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Title: Ab Initio Study of Electronic and Magnetic Properties in ZnO-Doped and Co-doped by Vanadium and Silver

Abstract

Based upon the ab initio of spin density functional calculation, the electronic and magnetic properties of Zn{sub 1−x}M{sub x}O (M = Ag or V) and Zn{sub 1−x−y}A{sub x}B{sub y}O (A = V; B = Ag) are investigated, using the Korringa-Kohn-Rostoker (KKR) method coupled with the coherent potential approximation (CPA). The total and partial densities of state are calculated. The effect of concentration values in Zn{sub 1−x}V{sub x}O and Zn{sub 1−x−y}V{sub x}Ag{sub y}O are deduced. Moreover, the magnetic disorder local moment (DLM) and the total energy are obtained for different concentration values of doped and co-doped zinc oxide (ZnO).

Authors:
; ; ;  [1];  [2];  [1]
  1. LPHE-MS, Faculty of Science, Mohammed V University (Morocco)
  2. Mohammed V University, Laboratory of Condensed Matter and Interdisciplinary Sciences (Morocco)
Publication Date:
OSTI Identifier:
22773972
Resource Type:
Journal Article
Journal Name:
Journal of Superconductivity and Novel Magnetism
Additional Journal Information:
Journal Volume: 31; Journal Issue: 7; Other Information: Copyright (c) 2018 Springer Science+Business Media, LLC, part of Springer Nature; http://www.springer-ny.com; Country of input: International Atomic Energy Agency (IAEA); Journal ID: ISSN 1557-1939
Country of Publication:
United States
Language:
English
Subject:
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY; APPROXIMATIONS; COBALT; CONCENTRATION RATIO; DENSITY FUNCTIONAL METHOD; DENSITY OF STATES; DOPED MATERIALS; ELECTRICAL PROPERTIES; SILVER; VANADIUM; ZINC OXIDES

Citation Formats

Es-semyhy, M., Ouahman, M., Bounagui, O. El, Bentayeb, F., Tahiri, N., E-mail: tahiri.najim@gmail.com, and Erraoudi, M. Ab Initio Study of Electronic and Magnetic Properties in ZnO-Doped and Co-doped by Vanadium and Silver. United States: N. p., 2018. Web. doi:10.1007/S10948-017-4469-7.
Es-semyhy, M., Ouahman, M., Bounagui, O. El, Bentayeb, F., Tahiri, N., E-mail: tahiri.najim@gmail.com, & Erraoudi, M. Ab Initio Study of Electronic and Magnetic Properties in ZnO-Doped and Co-doped by Vanadium and Silver. United States. doi:10.1007/S10948-017-4469-7.
Es-semyhy, M., Ouahman, M., Bounagui, O. El, Bentayeb, F., Tahiri, N., E-mail: tahiri.najim@gmail.com, and Erraoudi, M. Sun . "Ab Initio Study of Electronic and Magnetic Properties in ZnO-Doped and Co-doped by Vanadium and Silver". United States. doi:10.1007/S10948-017-4469-7.
@article{osti_22773972,
title = {Ab Initio Study of Electronic and Magnetic Properties in ZnO-Doped and Co-doped by Vanadium and Silver},
author = {Es-semyhy, M. and Ouahman, M. and Bounagui, O. El and Bentayeb, F. and Tahiri, N., E-mail: tahiri.najim@gmail.com and Erraoudi, M.},
abstractNote = {Based upon the ab initio of spin density functional calculation, the electronic and magnetic properties of Zn{sub 1−x}M{sub x}O (M = Ag or V) and Zn{sub 1−x−y}A{sub x}B{sub y}O (A = V; B = Ag) are investigated, using the Korringa-Kohn-Rostoker (KKR) method coupled with the coherent potential approximation (CPA). The total and partial densities of state are calculated. The effect of concentration values in Zn{sub 1−x}V{sub x}O and Zn{sub 1−x−y}V{sub x}Ag{sub y}O are deduced. Moreover, the magnetic disorder local moment (DLM) and the total energy are obtained for different concentration values of doped and co-doped zinc oxide (ZnO).},
doi = {10.1007/S10948-017-4469-7},
journal = {Journal of Superconductivity and Novel Magnetism},
issn = {1557-1939},
number = 7,
volume = 31,
place = {United States},
year = {2018},
month = {7}
}