Structure, Dynamics, and Spectral Diffusion of Water from First-Principles Molecular Dynamics
Author:
Affiliation:
1. Institute for Computational Molecular Science and Department of Chemistry, Temple University, Philadelphia, Pennsylvania 19122, United States
2. Indian Institute of Technology, Kanpur 208016, India
Funder
Basic Energy Sciences
Department of Science and Technology, Ministry of Science and Technology
Council of Scientific and Industrial Research
Publisher
American Chemical Society (ACS)
Subject
Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials
Link
https://pubs.acs.org/doi/pdf/10.1021/jp506120t
Reference95 articles.
1. Water Structure from Scattering Experiments and Simulation
2. Ultrafast Vibrational Population Dynamics of Water and Related Systems: A Theoretical Perspective
3. The electronic properties of water molecules in water clusters and liquid water
4. The dipole moment of water. I. Dipole moments and hyperfine properties of H2O and HDO in the ground and excited vibrational states
Cited by 145 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. A Computational Study of Structure, Dynamics, and Spectral Properties of Ionic Liquids: Wavelet Spectra as a Tool to Assess Microscopic Dynamics of Ionic Liquids;Ionic Liquids - Recent Advances [Working Title];2024-09-12
2. The structure of water–ammonia mixtures from classical and ab initio molecular dynamics;The Journal of Chemical Physics;2024-09-04
3. Mechanistic Insights into N2O5-Halide Ions Chemistry at the Air–Water Interface;Journal of the American Chemical Society;2024-07-29
4. Tungsten speciation in hydrothermal fluids;Geochimica et Cosmochimica Acta;2024-06
5. Redefined ion association constants have consequences for calcium phosphate nucleation and biomineralization;Nature Communications;2024-04-18
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