Ab initio spectroscopy of water under electric fields
Author:
Affiliation:
1. Institute of Biophysics of the Czech Academy of Sciences
2. Královopolská 135
3. 61265 Brno
4. Czech Republic
5. CNR-IPCF
6. Viale Ferdinando Stagno d'Alcontres 37
7. 98158 Messina
8. Italy
Abstract
IR and Raman spectra of bulk liquid water under intense electric fields reveal the contraction of both spectra and the onset of a novel high-frequency librational mode band. Moreover, the water structure evolves toward “ice-like” arrangements.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP03101D
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4. Vibrational Spectroscopy as a Probe of Structure and Dynamics in Liquid Water
5. Communication: Influence of external static and alternating electric fields on water from long-time non-equilibrium ab initio molecular dynamics
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