Metal-to-Insulating Transition in the Perovskite System YSr2Cu2FeO8−δ(0 < δ < 1) Modeled by DFT Methods
Author:
Affiliation:
1. Departamento de Química Inorgánica, Universidad Complutense de Madrid, 28040 Madrid, Spain
2. Department of Quantum Matter Physics, University of Geneva, CH-1211 Geneva, Switzerland
Funder
Comunidad de Madrid
Agencia Estatal de Investigaci?n
Universidad Complutense de Madrid
Ministerio de Ciencia e Innovaci?n
Publisher
American Chemical Society (ACS)
Subject
Inorganic Chemistry,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.inorgchem.2c03475
Reference60 articles.
1. Roadmap on inorganic perovskites for energy applications
2. Inhomogeneous Electron Gas
3. Self-Consistent Equations Including Exchange and Correlation Effects
4. Generalized gradient approximations for exchange and correlation: A look backward and forward
5. Accurate and simple density functional for the electronic exchange energy: Generalized gradient approximation
Cited by 6 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. Triple Magnetic Stacking in an Iron-Containing Cuprate with Cu–Fe–Cu Magnetic Blocks;Chemistry of Materials;2024-08-27
2. Ab Initio Investigation of Oxygen Ion Diffusion in the Layered Perovskite System YSr2Cu2FeO7+δ (0 < δ < 1);Applied Sciences;2024-07-27
3. Upgrading photocatalytic hydrogen evolution in Ba–Sr–Ta–O perovskite-type layered structures;International Journal of Hydrogen Energy;2024-04
4. DFT + U study of the structural, electronic and magnetic properties in the EuCoO3, EuFeO3, and EuCo0.5Fe0.5O3 type perovskite compounds;Journal of Magnetism and Magnetic Materials;2024-01
5. The SCAN+U method in the investigation of complex transition metal oxides: a case study on YSr2Cu2FeO7+δ (δ = 0, 1);Physical Chemistry Chemical Physics;2024
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