Individual Ion Activity Coefficients in Aqueous Electrolytes from Explicit-Water Molecular Dynamics Simulations
Author:
Affiliation:
1. Department of Chemical and Biological Engineering, Princeton University, Princeton, New Jersey 08544, United States
Funder
European Commission
National Science Foundation
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpcb.1c04019
Reference93 articles.
1. Modeling technologies for desalination of brackish water — toward a sustainable water supply
2. Frontiers of Membrane Desalination Processes for Brackish Water Treatment: A Review
3. Electrochemistry of proteins at the interface between two immiscible electrolyte solutions
4. Cation specific binding with protein surface charges
5. Rowan, E.; Engle, M.; Kirby, C.; Kraemer, T. Radium content of oil-and gas-field produced waters in the Northern Appalachian Basin (USA): Summary and discussion of data. US Geological Survey Scientific Investigations Report 2011, 5135, 31.
Cited by 21 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. Theoretical considerations on single and mixed solvent electrolyte solutions;Fluid Phase Equilibria;2024-01
2. Coarse-Grained Molecular Dynamics Modeling of Polyvinyl Chloride: Solvent Interactions, Mechanical Behavior, and Dehydrochlorination Effects;Macromolecules;2023-12-05
3. Resurrection of Hückel’s idea: Decoupling ion–ion and ion–water terms in activity coefficients via the state-dependent dielectric constant;Fluid Phase Equilibria;2023-09
4. Comparisons of equation of state models for electrolytes: e-CPA and e-PPC-SAFT;Fluid Phase Equilibria;2023-08
5. Self-Consistent Implementation of a Solvation Free Energy Framework to Predict the Salt Solubilities of Six Alkali Halides;Journal of Chemical Theory and Computation;2023-07-20
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