A Nonorthogonal State-Interaction Approach for Matrix Product State Wave Functions
Author:
Affiliation:
1. Laboratorium für Physikalische Chemie, ETH Zürich, Vladimir-Prelog-Weg 2, 8093 Zürich, Switzerland
2. Department of Chemistry, University at Buffalo, State University of New York, New York 14260-3000, United States
Funder
Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung
Basic Energy 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.6b00889
Reference112 articles.
1. Nonadiabatic dynamics with trajectory surface hopping method
2. A general method to describe intersystem crossing dynamics in trajectory surface hopping
3. Light-Induced Excited Spin State Trapping: Ab Initio Study of the Physics at the Molecular Level
4. Ultrafast cascading theory of intersystem crossings in transition-metal complexes
5. Spin-orbit coupling and intersystem crossing in molecules
Cited by 41 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. SCINE—Software for chemical interaction networks;The Journal of Chemical Physics;2024-06-10
2. Consistent Second-Order Treatment of Spin–Orbit Coupling and Dynamic Correlation in Quasidegenerate N-Electron Valence Perturbation Theory;Journal of Chemical Theory and Computation;2024-05-25
3. Triplet‐Singlet Emission of d‐Block Metal Complexes Characterized by Spin‐Orbit Natural Transition Orbitals;ChemistryOpen;2024-03-05
4. Analytic gradients for relativistic exact-two-component equation-of-motion coupled-cluster singles and doubles method;The Journal of Chemical Physics;2023-12-28
5. SOiCISCF: Combining SOiCI and iCISCF for Variational Treatment of Spin–Orbit Coupling;Journal of Chemical Theory and Computation;2023-09-20
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