Combining Renormalized Singles GW Methods with the Bethe–Salpeter Equation for Accurate Neutral Excitation Energies
Author:
Affiliation:
1. Department of Chemistry, Duke University, Durham, North Carolina27708, United States
2. Faculty of Chemistry and Food Chemistry, Technische Universität Dresden, 01062Dresden, Germany
Funder
Division of Chemistry
Deutsche Forschungsgemeinschaft
National Institute of General Medical Sciences
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.2c00686
Reference105 articles.
1. Optical control of antibacterial activity
2. Azobenzene Photoswitching without Ultraviolet Light
3. The effects of macrocycle and anchoring group replacements on the performance of porphyrin based sensitizer: DFT and TD-DFT study
4. DFT and TD-DFT study on structure and properties of organic dye sensitizer TA-St-CA
5. Density-Functional Theory for Time-Dependent Systems
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. BSE@GW Prediction of Charge Transfer Exciton in Molecular Complexes: Assessment of Self-Energy and Exchange-Correlation Dependence;The Journal of Physical Chemistry A;2024-07-16
2. Compilation and deciphering MoS2’s physical properties: Accurate benchmark DFT simulations and assessment of advanced quantum methods;Chemical Physics;2024-04
3. Non-linear light–matter interactions from the Bethe–Salpeter equation;The Journal of Chemical Physics;2024-02-09
4. Benchmarking the accuracy of the separable resolution of the identity approach for correlated methods in the numeric atom-centered orbitals framework;The Journal of Chemical Physics;2024-01-11
5. Linear Scaling Calculations of Excitation Energies with Active-Space Particle–Particle Random-Phase Approximation;The Journal of Physical Chemistry A;2023-09-11
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