Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films

Here, we report an anisotropic small-hole polaron in an orthorhombic structure of BiVO₄ films grown by pulsed-laser deposition on yttrium-doped zirconium oxide substrate. The polaronic state and electronic structure of BiVO₄ films are revealed using a combination of polarization-dependent x-ray abso...

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Main Authors: Chaudhuri, A., Mandal, L., Chi, X., Yang, M., Scott, M. C., Motapothula, M., Yu, X. J., Yang, P., Venkatesan, T., Wee, A. T. S., Rusydi, A., Shao-Horn, Yang
Other Authors: Massachusetts Institute of Technology. Department of Mechanical Engineering
Format: Article
Language:English
Published: American Physical Society 2018
Online Access:http://hdl.handle.net/1721.1/115989
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author Chaudhuri, A.
Mandal, L.
Chi, X.
Yang, M.
Scott, M. C.
Motapothula, M.
Yu, X. J.
Yang, P.
Venkatesan, T.
Wee, A. T. S.
Rusydi, A.
Shao-Horn, Yang
author2 Massachusetts Institute of Technology. Department of Mechanical Engineering
author_facet Massachusetts Institute of Technology. Department of Mechanical Engineering
Chaudhuri, A.
Mandal, L.
Chi, X.
Yang, M.
Scott, M. C.
Motapothula, M.
Yu, X. J.
Yang, P.
Venkatesan, T.
Wee, A. T. S.
Rusydi, A.
Shao-Horn, Yang
author_sort Chaudhuri, A.
collection MIT
description Here, we report an anisotropic small-hole polaron in an orthorhombic structure of BiVO₄ films grown by pulsed-laser deposition on yttrium-doped zirconium oxide substrate. The polaronic state and electronic structure of BiVO₄ films are revealed using a combination of polarization-dependent x-ray absorption spectroscopy at VL[subscript 3,2] edges, spectroscopic ellipsometry, x-ray photoemission spectroscopies, and high-resolution x-ray diffraction with the support of first-principles calculations. We find that in the orthorhombic phase, which is slightly different from the conventional pucherite structure, the unoccupied V 3d orbitals and charge inhomogeneities lead to an anisotropic small-hole polaron state. Our result shows the importance of the interplay of charge and lattice for the formation of a hole polaronic state, which has a significant impact in the electrical conductivity of BiVO₄, hence its potential use as a photoanode for water splitting.
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spelling mit-1721.1/1159892022-10-02T02:11:20Z Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films Chaudhuri, A. Mandal, L. Chi, X. Yang, M. Scott, M. C. Motapothula, M. Yu, X. J. Yang, P. Venkatesan, T. Wee, A. T. S. Rusydi, A. Shao-Horn, Yang Massachusetts Institute of Technology. Department of Mechanical Engineering Shao-Horn, Yang Here, we report an anisotropic small-hole polaron in an orthorhombic structure of BiVO₄ films grown by pulsed-laser deposition on yttrium-doped zirconium oxide substrate. The polaronic state and electronic structure of BiVO₄ films are revealed using a combination of polarization-dependent x-ray absorption spectroscopy at VL[subscript 3,2] edges, spectroscopic ellipsometry, x-ray photoemission spectroscopies, and high-resolution x-ray diffraction with the support of first-principles calculations. We find that in the orthorhombic phase, which is slightly different from the conventional pucherite structure, the unoccupied V 3d orbitals and charge inhomogeneities lead to an anisotropic small-hole polaron state. Our result shows the importance of the interplay of charge and lattice for the formation of a hole polaronic state, which has a significant impact in the electrical conductivity of BiVO₄, hence its potential use as a photoanode for water splitting. 2018-05-30T18:36:55Z 2018-05-30T18:36:55Z 2018-05 2018-04 2018-05-26T18:00:19Z Article http://purl.org/eprint/type/JournalArticle 2469-9950 2469-9969 http://hdl.handle.net/1721.1/115989 Chaudhuri, A. et al. "Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films." Physical Review B 97, 19 (May 2018): 195150 © 2018 American Physical Society en http://dx.doi.org/10.1103/PhysRevB.97.195150 Physical Review B Article is made available in accordance with the publisher's policy and may be subject to US copyright law. Please refer to the publisher's site for terms of use. American Physical Society application/pdf American Physical Society American Physical Society
spellingShingle Chaudhuri, A.
Mandal, L.
Chi, X.
Yang, M.
Scott, M. C.
Motapothula, M.
Yu, X. J.
Yang, P.
Venkatesan, T.
Wee, A. T. S.
Rusydi, A.
Shao-Horn, Yang
Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films
title Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films
title_full Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films
title_fullStr Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films
title_full_unstemmed Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films
title_short Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO₄ films
title_sort direct observation of anisotropic small hole polarons in an orthorhombic structure of bivo₄ films
url http://hdl.handle.net/1721.1/115989
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