Dielectric relaxation of water: assessing the impact of localized modes, translational diffusion, and collective dynamics-Reference-Cited by-同舟云学术

Dielectric relaxation of water: assessing the impact of localized modes, translational diffusion, and collective dynamics

Published:2021 Issue:37 Volume:23 Page:20875-20882
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Hölzl Christoph¹^ORCID,Forbert Harald²^ORCID,Marx Dominik¹

Affiliation:

1. Lehrstuhl für Theoretische Chemie, Ruhr-Universität Bochum, 44780 Bochum, Germany

2. Center for Solvation Science ZEMOS, Ruhr-Universität Bochum, 44780 Bochum, Germany

Abstract

The dielectric relaxation spectrum of water can be quantitatively reproduced by ab initio molecular dynamics simulations. Its decomposition into auto- and crosscorrelation terms suggests that fits of experimental spectra may require revision.

Funder

Deutsche Forschungsgemeinschaft

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2021/CP/D1CP03507J

Reference60 articles.

1. Fluctuation, relaxations, and hydration in liquid water. Hydrogen-bond rearrangement dynamics

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5. Water: A Tale of Two Liquids

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