Ferromagnetism in nitrogen-doped BaO: a self-interaction corrected DFT study
Author:
Affiliation:
1. Dipartimento di Scienza dei Materiali
2. Università Milano Bicocca
3. 20125 Milano
4. Italy
Abstract
The magnetic interaction between N dopants in different positions has been investigated by means of an accurate and robust DFT approach.
Funder
Fondazione Cariplo
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2017/CP/C6CP07535E
Reference56 articles.
1. Spectroscopic Properties of Doped and Defective Semiconducting Oxides from Hybrid Density Functional Calculations
2. Trends in non-metal doping of anatase TiO2: B, C, N and F
3. Materials Design of Transparent and Half-Metallic Ferromagnets of MgO, SrO and BaO without Magnetic Elements
4. New Class of Diluted Ferromagnetic Semiconductors based on CaO without Transition Metal Elements
5. New Class of High-TC Diluted Ferromagnetic Semiconductors Based on CaO without Transition Metal Elements
Cited by 8 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. Theoretical characterization of induced ferromagnetism, half-metallic behavior, electronic properties in new Ti-doped BaO;Optical and Quantum Electronics;2021-06
2. Estimation of spin contamination errors in DFT/plane-wave calculations of solid materials using approximate spin projection scheme;Chemical Physics Letters;2021-02
3. Enhanced optical absorption of rutile TiO2 through (Sm, C) codoping: a first-principles study;Optical and Quantum Electronics;2021-01-25
4. Study of d0 magnetism of BaF2 nanopowder after thermal and radiation exposure;Journal of Magnetism and Magnetic Materials;2020-06
5. Investigation of the Substituting Effect of Chromium on the Electronic Structures and the Half-Metallic Ferromagnetic Properties of BaO;Journal of Superconductivity and Novel Magnetism;2018-09-17
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3