Basis set effects on coupled cluster benchmarks of electronically excited states: CC3, CCSDR(3) and CC2-Reference-Cited by-同舟云学术

登录注册会员服务联系我们

Basis set effects on coupled cluster benchmarks of electronically excited states: CC3, CCSDR(3) and CC2

Published:2010-02-10 Issue:3-4 Volume:108 Page:453-465
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Silva-Junior Mario R.,Sauer Stephan P.A.,Schreiber Marko,Thiel Walter

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

http://www.tandfonline.com/doi/pdf/10.1080/00268970903549047

Reference30 articles.

1. Benchmarks for electronically excited states: CASPT2, CC2, CCSD, and CC3

2. Benchmarks for electronically excited states: Time-dependent density functional theory and density functional theory based multireference configuration interaction

3. Benchmarks for Electronically Excited States: A Comparison of Noniterative and Iterative Triples Corrections in Linear Response Coupled Cluster Methods: CCSDR(3) versus CC3

4. Computation of accurate excitation energies for large organic molecules with double-hybrid density functionals

5. Extensive TD-DFT Benchmark: Singlet-Excited States of Organic Molecules

Cited by 147 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. Reference CC3 Excitation Energies for Organic Chromophores: Benchmarking TD-DFT, BSE/GW, and Wave Function Methods;Journal of Chemical Theory and Computation;2024-09-05

2. Performance of range-separated long-range SOPPA short-range density functional theory method for vertical excitation energies;The Journal of Chemical Physics;2024-05-22

3. Quantum Equation of Motion with Orbital Optimization for Computing Molecular Properties in Near-Term Quantum Computing;Journal of Chemical Theory and Computation;2024-05-03

4. A mountaineering strategy to excited states: Accurate vertical transition energies and benchmarks for substituted benzenes;Journal of Computational Chemistry;2024-04-25

5. Role of Singles Amplitudes in ADC(2) and CC2 for Low-Lying Electronically Excited States;Journal of Chemical Theory and Computation;2024-03-07

同舟云学术

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