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Chemically selective alternatives to photoferroelectrics for polarization-enhanced photocatalysis : the untapped potential of hybrid inorganic nanotubes

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Elliott, Joshua D., Poli, Emiliano, Scivetti, Ivan, Ratcliff, Laura E., Andrinopoulos, Lampros, Dziedzic, Jacek, Hine, Nicholas, Mostofi, Arash A., Skylaris, Chris-Kriton, Haynes, Peter D. and Teobaldi, Gilberto (2016) Chemically selective alternatives to photoferroelectrics for polarization-enhanced photocatalysis : the untapped potential of hybrid inorganic nanotubes. Advanced Science . 1600153. doi:10.1002/advs.201600153

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Official URL: http://dx.doi.org/10.1002/advs.201600153

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Abstract

Linear-scaling density functional theory simulation of methylated imogolite nanotubes (NTs) elucidates the interplay between wall-polarization, bands separation, charge-transfer excitation, and tunable electrostatics inside and outside the NT-cavity. The results suggest that integration of polarization-enhanced selective photocatalysis and chemical separation into one overall dipole-free material should be possible. Strategies are proposed to increase the NT polarization for maximally enhanced electron–hole separation.

Item Type: Journal Article
Subjects: Q Science > QD Chemistry
Divisions: Faculty of Science, Engineering and Medicine > Science > Physics
Library of Congress Subject Headings (LCSH): Photocatalysis , Nanotubes
Journal or Publication Title: Advanced Science
Publisher: Wiley - V C H Verlag GmbH & Co. KGaA
ISSN: 2198-3844
Official Date: 13 September 2016
Dates:
DateEvent
13 September 2016Available
12 July 2016Accepted
21 April 2016Submitted
Article Number: 1600153
DOI: 10.1002/advs.201600153
Status: Peer Reviewed
Publication Status: Published
Access rights to Published version: Restricted or Subscription Access
Funder: Engineering and Physical Sciences Research Council (EPSRC), Poland. Ministerstwo Nauki i Szkolnictwa Wyższego [Ministry of Science and Higher Education]
Grant number: EP/I004483/1, EP/J015059/1, EP/K000225/1, EP/K013610/1 (EPSRC), IP2012 043972

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