Active learning of potential-energy surfaces of weakly bound complexes with regression-tree ensembles-Reference-Cited by-同舟云学术

登录注册会员服务联系我们

Active learning of potential-energy surfaces of weakly bound complexes with regression-tree ensembles

Published:2021-10-14 Issue:14 Volume:155 Page:144109
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Saleh Yahya¹²^ORCID,Sanjay Vishnu¹²³^ORCID,Iske Armin²,Yachmenev Andrey¹³^ORCID,Küpper Jochen¹³⁴⁵^ORCID

Affiliation:

1. Center for Free-Electron Laser Science CFEL, Deutsches Elektronen-Synchrotron DESY, Notkestraße 85, 22607 Hamburg, Germany

2. Department of Mathematics, Universität Hamburg, Bundesstraße 55, 20146 Hamburg, Germany

3. Center for Ultrafast Imaging, Universität Hamburg, Luruper Chaussee 149, 22761 Hamburg, Germany

4. Department of Chemistry, Universität Hamburg, Martin-Luther-King-Platz 6, 20146 Hamburg, Germany

5. Department of Physics, Universität Hamburg, Luruper Chaussee 149, 22761 Hamburg, Germany

Funder

Deutsche Forschungsgemeinschaft

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

https://aip.scitation.org/doi/pdf/10.1063/5.0057051

Reference99 articles.

1. Quantum Dynamical Resonances in Chemical Reactions: From A + BC to Polyatomic Systems

2. Roaming Reactions and Dynamics in the van der Waals Region

3. Protein Solvation in Allosteric Regulation: A Water Effect on Hemoglobin

4. THE SPECTROSCOPY OF SOLVATION IN HYDROGEN-BONDED AROMATIC CLUSTERS

5. Indole−H2O in the Gas Phase. Structures, Barriers to Internal Motion, and S1 ← S0 Transition Moment Orientation. Solvent Reorganization in the Electronically Excited State

Cited by 2 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. From the Automated Calculation of Potential Energy Surfaces to Accurate Infrared Spectra;The Journal of Physical Chemistry Letters;2024-03-13

2. An Introduction to Machine Learning in Molecular Sciences;Challenges and Advances in Computational Chemistry and Physics;2023

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