Koopmans-compliant screened exchange potential with correct asymptotic behavior for semiconductors
Author:
Funder
Deutsche Forschungsgemeinschaft
Supercomputer Center of Northern Germany
Publisher
American Physical Society (APS)
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.102.235168/fulltext
Reference46 articles.
1. Density-Functional Theory for Fractional Particle Number: Derivative Discontinuities of the Energy
2. Self-interaction correction to density-functional approximations for many-electron systems
3. Self-interaction-corrected pseudopotentials for silicon carbide
4. Screened exchange density functional applied to solids
5. Intrinsic defects in ZnO calculated by screened exchange and hybrid density functionals
Cited by 11 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. Screened optimally tuned range separated hybrid functional for solvated low bandgap molecular systems;The Journal of Chemical Physics;2024-07-15
2. Efficient all-electron hybrid density functionals for atomistic simulations beyond 10 000 atoms;The Journal of Chemical Physics;2024-07-11
3. Simple and effective screening parameter for range-separated dielectric-dependent hybrids;Physical Review B;2023-07-05
4. Range-separated hybrid functionals for accurate prediction of band gaps of extended systems;npj Computational Materials;2023-06-21
5. Size of electron polarons in anatase TiO2 and their role in photocatalysis;Physical Review B;2023-04-14
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