Rectified Water Migration Behavior in the Noncentrosymmetric Channels of a Ferroelectric Proton Conductor

Rectified Water Migration Behavior in the Noncentrosymmetric Channels of a Ferroelectric Proton Conductor

Ferroelectric ion conductors composed of noncentrosymmetric host structures and guest water molecules have recently garnered attention. These systems exhibit colossal polarization driven by long ion displacement facilitated by water molecules; however, the manner in which water molecules are perturb...

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Bibliographic Details
Main Author: Yuta Tsuji (1477624) (author)
Other Authors: Ryo Ohtani (2101120) (author)
Published: 2025
Subjects:
Biophysics
Biochemistry
Medicine
Cell Biology
Biotechnology
Ecology
Biological Sciences not elsewhere classified
Chemical Sciences not elsewhere classified
using various first
significant directional preference
recently garnered attention
principles computational methods
potential energy surface
lower activation barrier
internal electric field
noncentrosymmetric host structures
directs water flow
guest water molecules
cn )< sub
2 </ sub
aimd simulations demonstrated
water molecules
water molecule
noncentrosymmetric channels
cn ligands
c </
polar framework
equilibrium positions
anisotropic arrangements
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