Abinitiopair potential parameter set for the interaction of a rigid and a flexible water model and the complete series of the halides and alkali cations
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.472392
Reference35 articles.
1. Study of the Structure of Molecular Complexes. I. Energy Surface of a Water Molecule in the Field of a Lithium Positive Ion
2. Study of the structure of molecular complexes. II. Energy surfaces for a water molecule in the field of a sodium or potassium cation
3. Study of the structure of molecular complexes. III. Energy surface of a water molecule in the field of a fluorine or chlorine anion
4. Study of the structure of molecular complexes. V. Heat of formation for the Li+, Na+, K+, F−, and Cl− ion complexes with a single water molecule
5. A Molecular Dynamics Study of Aqueous Solutions
Cited by 52 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. Going beyond Radial Hydration Models: The Hidden Structures of Chloride and Iodide Aqua Ions Revealed by the Use of Lone Pairs;The Journal of Physical Chemistry B;2023-12-08
2. Solvent Dynamics of Aqueous Halides before and after Photoionization;The Journal of Physical Chemistry B;2023-02-02
3. Structure and dynamics of the Li+ ion in water, methanol and acetonitrile solvents: ab initio molecular dynamics simulations;Physical Chemistry Chemical Physics;2023
4. Effect of alkali metal ions on water structure: insights into the pressure-like effect;Structural Chemistry;2022-11-22
5. The effects of cations and concentration on reaction mechanism of alkali-activated blast furnace ferronickel slag;Composites Part B: Engineering;2022-05
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