A new generation of diagonal self-energies for the calculation of electron removal energies
Author:
Affiliation:
1. Department of Chemistry and Biochemistry, Auburn University, Auburn, Alabama 36849-5312, USA
Funder
National Science Foundation
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
https://aip.scitation.org/doi/pdf/10.1063/5.0070849
Reference74 articles.
1. Propagators in Quantum Chemistry
2. Many-Body Methods for Atoms, Molecules and Clusters
3. Dyson-orbital concepts for description of electrons in molecules
4. Concepts of chemical bonding from electron propagator theory
Cited by 24 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. Fourth-Order Algebraic Diagrammatic Construction for Electron Detachment and Attachment: The IP- and EA-ADC(4) Methods;The Journal of Physical Chemistry A;2024-08-30
2. Molecular Ionization Energies from GW and Hartree–Fock Theory: Polarizability, Screening, and Self-Energy Vertex Corrections;Journal of Chemical Theory and Computation;2024-08-27
3. Electron Binding Energies of Open-Shell Species from Diagonal Electron-Propagator Self-Energies with Unrestricted Hartree–Fock Spin–Orbitals;The Journal of Physical Chemistry A;2024-08-14
4. Impact of substituents at the para position of C-Nitroso over N-Nitroso diphenylamine on static and frequency dependent nonlinear optical Properties: DFT and TD-DFT;Computational and Theoretical Chemistry;2024-07
5. Ab Initio Electron Propagators with an Hermitian, Intermediately Normalized Superoperator Metric Applied to Vertical Electron Affinities;The Journal of Physical Chemistry A;2024-05-30
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