Going beyond the vertical approximation with time-dependent density functional theory
Author:
Affiliation:
1. CNR-Consiglio Nazionale delle Ricerche; Istituto di Chimica dei Composti OrganoMetallici (ICCOM-CNR); Pisa Italy
2. CEISAM, UMR CNRS 6230; Université de Nantes; Nantes France
3. Institut Universitaire de France; Paris France
Funder
European Research Council and the Région des Pays de la Loire
Italian MIUR
Publisher
Wiley
Subject
Materials Chemistry,Computational Mathematics,Physical and Theoretical Chemistry,Computer Science Applications,Biochemistry
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/wcms.1260/fullpdf
Reference191 articles.
1. Density-functional theory for time-dependent systems;Runge;Phys Rev Lett,1984
2. Time-dependent density-functional theory for molecules and molecular solids;Casida;J Mol Struct (THEOCHEM),2009
3. Applications of time dependent and time independent density functional theory to the first π to π⋆ transition in cyanine dyes;Zhekova;J Chem Theory Comput,2014
4. Taking up the cyanine challenge with quantum tools;Le Guennic;Acc Chem Res,2015
Cited by 202 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. Toward the improvement of vibronic spectra and non-radiative rate constants using the vertical Hessian method;The Journal of Chemical Physics;2024-09-05
2. Stimuli‐Induced Fluorescence Switching in Azine‐Containing Fluorophores Displaying Resonance‐Stabilized ESIPT Emission;Chemistry – A European Journal;2024-09-05
3. 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
4. Rapid and complete prediction of alizarin in solution by combining experimental data with computational methods;Dyes and Pigments;2024-09
5. GPU-accelerated on-the-fly nonadiabatic semiclassical dynamics;The Journal of Chemical Physics;2024-08-28
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