The nature of three-body interactions in DFT: Exchange and polarization effects-Reference-Cited by-同舟云学术

登录注册会员服务联系我们

The nature of three-body interactions in DFT: Exchange and polarization effects

Published:2017-08-28 Issue:8 Volume:147 Page:084106
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Hapka Michał¹,Rajchel Łukasz²,Modrzejewski Marcin¹^ORCID,Schäffer Rainer²,Chałasiński Grzegorz¹,Szczęśniak Małgorzata M.³

Affiliation:

1. Faculty of Chemistry, University of Warsaw, ul. L. Pasteura 1, 02-093 Warsaw, Poland

2. Faculty of Chemistry, University of Duisburg-Essen, Universitätsstraße 5, 45117 Essen, Germany

3. Department of Chemistry, Oakland University, Rochester, Michigan 48309-4477, USA

Funder

National Science Foundation (NSF)

Narodowe Centrum Nauki (NCN)

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/am-pdf/10.1063/1.4986291

Reference87 articles.

1. K. Szalewicz, R. Bukowski, and B. Jeziorski, in Theory and Applications of Computational Chemistry, edited by C. E. Dykstra, G. Frenking, K. S. Kim, and G. E. Scuseria (Elsevier, Amsterdam, 2005), pp. 919–962.

2. Ab initio three-body interactions for water. II. Effects on structure and energetics of liquid

3. Fast electron correlation methods for molecular clusters without basis set superposition errors

4. Assessing the accuracy of quantum Monte Carlo and density functional theory for energetics of small water clusters

5. First-principles energetics of water clusters and ice: A many-body analysis

Cited by 16 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. Post-Kohn–Sham Random-Phase Approximation and Correction Terms in the Expectation-Value Coupled-Cluster Formulation;Journal of Chemical Theory and Computation;2023-09-29

2. Assessment of random phase approximation and second-order Møller–Plesset perturbation theory for many-body interactions in solid ethane, ethylene, and acetylene;The Journal of Chemical Physics;2023-04-14

3. Accurate three-body noncovalent interactions: the insights from energy decomposition;Physical Chemistry Chemical Physics;2023

4. Is an Inductive Effect Explicit Account Required for Atomic Charges Aimed at Use within the Force Fields?;The Journal of Physical Chemistry A;2022-09-02

5. Crystal Structure Predictions for 4-Amino-2,3,6-trinitrophenol Using a Tailor-Made First-Principles-Based Force Field;Crystal Growth & Design;2022-01-24

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