Shift current bulk photovoltaic effect in polar materials—hybrid and oxide perovskites and beyond
Abstract
Here, the bulk photovoltaic effect (BPVE) refers to the generation of a steady photocurrent and above-bandgap photovoltage in a single-phase homogeneous material lacking inversion symmetry. The mechanism of BPVE is decidedly different from the typical p–n junction-based photovoltaic mechanism in heterogeneous materials. Recently, there has been renewed interest in ferroelectric materials for solar energy conversion, inspired by the discovery of above-bandgap photovoltages in ferroelectrics, the invention of low bandgap ferroelectric materials and the rapidly improving power conversion efficiency of metal halide perovskites. However, as long as the nature of the BPVE and its dependence on composition and structure remain poorly understood, materials engineering and the realisation of its true potential will be hampered. In this review article, we survey the history, development and recent progress in understanding the mechanisms of BPVE, with a focus on the shift current mechanism, an intrinsic BPVE that is universal to all materials lacking inversion symmetry. In addition to explaining the theory of shift current, materials design opportunities and challenges will be discussed for future applications of the BPVE.
- Authors:
-
- Univ. of Pennsylvania, Philadelphia, PA (United States)
- United States Naval Research Lab., Washington, D.C. (United States)
- Carnegie Institution of Science, Washington, D.C. (United States)
- Publication Date:
- Research Org.:
- Univ. of Pennsylvania, Philadelphia, PA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Advanced Scientific Computing Research (ASCR)
- OSTI Identifier:
- 1434900
- Grant/Contract Number:
- FG02-07ER46431
- Resource Type:
- Accepted Manuscript
- Journal Name:
- npj Computational Materials
- Additional Journal Information:
- Journal Volume: 2; Journal Issue: 1; Journal ID: ISSN 2057-3960
- Publisher:
- Nature Publishing Group
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; Electronic properties and materials; Electronic structure; Nonlinear optics; Solar cells
Citation Formats
Tan, Liang Z., Zheng, Fan, Young, Steve M., Wang, Fenggong, Liu, Shi, and Rappe, Andrew M. Shift current bulk photovoltaic effect in polar materials—hybrid and oxide perovskites and beyond. United States: N. p., 2016.
Web. doi:10.1038/npjcompumats.2016.26.
Tan, Liang Z., Zheng, Fan, Young, Steve M., Wang, Fenggong, Liu, Shi, & Rappe, Andrew M. Shift current bulk photovoltaic effect in polar materials—hybrid and oxide perovskites and beyond. United States. https://doi.org/10.1038/npjcompumats.2016.26
Tan, Liang Z., Zheng, Fan, Young, Steve M., Wang, Fenggong, Liu, Shi, and Rappe, Andrew M. Fri .
"Shift current bulk photovoltaic effect in polar materials—hybrid and oxide perovskites and beyond". United States. https://doi.org/10.1038/npjcompumats.2016.26. https://www.osti.gov/servlets/purl/1434900.
@article{osti_1434900,
title = {Shift current bulk photovoltaic effect in polar materials—hybrid and oxide perovskites and beyond},
author = {Tan, Liang Z. and Zheng, Fan and Young, Steve M. and Wang, Fenggong and Liu, Shi and Rappe, Andrew M.},
abstractNote = {Here, the bulk photovoltaic effect (BPVE) refers to the generation of a steady photocurrent and above-bandgap photovoltage in a single-phase homogeneous material lacking inversion symmetry. The mechanism of BPVE is decidedly different from the typical p–n junction-based photovoltaic mechanism in heterogeneous materials. Recently, there has been renewed interest in ferroelectric materials for solar energy conversion, inspired by the discovery of above-bandgap photovoltages in ferroelectrics, the invention of low bandgap ferroelectric materials and the rapidly improving power conversion efficiency of metal halide perovskites. However, as long as the nature of the BPVE and its dependence on composition and structure remain poorly understood, materials engineering and the realisation of its true potential will be hampered. In this review article, we survey the history, development and recent progress in understanding the mechanisms of BPVE, with a focus on the shift current mechanism, an intrinsic BPVE that is universal to all materials lacking inversion symmetry. In addition to explaining the theory of shift current, materials design opportunities and challenges will be discussed for future applications of the BPVE.},
doi = {10.1038/npjcompumats.2016.26},
journal = {npj Computational Materials},
number = 1,
volume = 2,
place = {United States},
year = {Fri Aug 26 00:00:00 EDT 2016},
month = {Fri Aug 26 00:00:00 EDT 2016}
}
Web of Science
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- Pal, Subhajit; Swain, Atal Bihari; Biswas, Pranab Parimal
- Scientific Reports, Vol. 8, Issue 1
Photo-sensitizing thin-film ferroelectric oxides using materials databases and high-throughput calculations
journal, January 2019
- Plata, Jose J.; Suárez, Javier Amaya; Cuesta-López, Santiago
- Journal of Materials Chemistry A, Vol. 7, Issue 48
Impact of electrodes on the extraction of shift current from a ferroelectric semiconductor SbSI
journal, December 2018
- Nakamura, M.; Hatada, H.; Kaneko, Y.
- Applied Physics Letters, Vol. 113, Issue 23
Polarization controlled photovoltaic and self-powered photodetector characteristics in Pb-free ferroelectric thin film
journal, January 2019
- Swain, Atal Bihari; Rath, Martando; Biswas, Pranab Parimal
- APL Materials, Vol. 7, Issue 1
Enhanced bulk photovoltaic response in Sn doped BaTiO 3 through composition dependent structural transformation
journal, May 2019
- Kola, Lakshmi; Murali, D.; Pal, Subhajit
- Applied Physics Letters, Vol. 114, Issue 18
Spectral dynamics of shift current in ferroelectric semiconductor SbSI
journal, January 2019
- Sotome, M.; Nakamura, M.; Fujioka, J.
- Proceedings of the National Academy of Sciences, Vol. 116, Issue 6
Spatio-temporal dynamics of shift current quantum pumping by femtosecond light pulse
journal, March 2019
- Bajpai, U.; Popescu, B. S.; Plecháč, P.
- Journal of Physics: Materials, Vol. 2, Issue 2
Optical response of the chiral topological semimetal RhSi
journal, October 2019
- Li, Zhi; Iitaka, Toshiaki; Zeng, Haibo
- Physical Review B, Vol. 100, Issue 15
Theory for shift current of bosons: Photogalvanic spin current in ferrimagnetic and antiferromagnetic insulators
journal, December 2019
- Ishizuka, Hiroaki; Sato, Masahiro
- Physical Review B, Vol. 100, Issue 22
Direct observation of shift and ballistic photovoltaic currents
journal, January 2019
- Burger, Aaron M.; Agarwal, Radhe; Aprelev, Alexey
- Science Advances, Vol. 5, Issue 1
Tetrathienoanthracene and Tetrathienylbenzene Derivatives as Hole-Transporting Materials for Perovskite Solar Cell
journal, July 2018
- Rojas, Diana Elizabeth Meza; Cho, Kyung Taek; Zhang, Yi
- Advanced Energy Materials, Vol. 8, Issue 25
Ferroelectric Oxides for Solar Energy Conversion, Multi‐Source Energy Harvesting/Sensing, and Opto‐Ferroelectric Applications
journal, May 2019
- Bai, Yang; Jantunen, Heli; Juuti, Jari
- ChemSusChem, Vol. 12, Issue 12
Releasing the hidden shift current in the TTF-CA organic molecular solid via symmetry lowering
journal, January 2020
- Kim, Bumseop; Kim, Jeongwoo; Shin, Dongbin
- npj Computational Materials, Vol. 6, Issue 1
Tetragonal CH 3 NH 3 PbI 3 is ferroelectric
journal, June 2017
- Rakita, Yevgeny; Bar-Elli, Omri; Meirzadeh, Elena
- Proceedings of the National Academy of Sciences, Vol. 114, Issue 28
Towards photoferroic materials by design: recent progress and perspectives
journal, November 2019
- Castelli, Ivano E.; Olsen, Thomas; Chen, Yunzhong
- Journal of Physics: Energy, Vol. 2, Issue 1
Large Bulk Photovoltaic Response by Symmetry-Breaking Structural Transformation in Ferroelectric [ ] 0.5 [( ] 0.5
journal, April 2019
- Bihari Swain, Atal; Murali, D.; Nanda, B. R. K.
- Physical Review Applied, Vol. 11, Issue 4
Nonequilibrium nature of nonlinear optical response: Application to the bulk photovoltaic effect
journal, January 2020
- Barik, Tamoghna; Sau, Jay D.
- Physical Review B, Vol. 101, Issue 4
Ultrafast Spin‐to‐Charge Conversion at the Surface of Topological Insulator Thin Films
journal, October 2018
- Wang, Xinbo; Cheng, Liang; Zhu, Dapeng
- Advanced Materials, Vol. 30, Issue 52
The Narrowest Band Gap Ever Observed in Molecular Ferroelectrics: Hexane-1,6-diammonium Pentaiodobismuth(III)
journal, December 2017
- Zhang, Han-Yue; Wei, Zhenhong; Li, Peng-Fei
- Angewandte Chemie International Edition, Vol. 57, Issue 2
Wannier90 as a community code: new features and applications
text, January 2020
- Pizzi, Giovanni; Vitale, Valerio; Al, Et
- IOP Publishing
Orbital controlled band gap engineering of tetragonal BiFeO 3 for optoelectronic applications
journal, January 2018
- Qiao, L.; Zhang, S.; Xiao, H. Y.
- Journal of Materials Chemistry C, Vol. 6, Issue 5
Terahertz surface and interface emission spectroscopy for advanced materials
journal, February 2019
- Huang, Yuanyuan; Yao, Zehan; He, Chuan
- Journal of Physics: Condensed Matter, Vol. 31, Issue 15
Wannier90 as a community code: New features and applications
text, January 2020
- Pizzi, Giovanni; Vitale, Valerio; Arita, Ryotaro
- ETH Zurich
Spatio-temporal dynamics of shift current quantum pumping by femtosecond light pulse
text, January 2018
- Bajpai, U.; Popescu, B. S.; Plechac, P.
- arXiv
Ab initio calculation of the shift photocurrent by Wannier interpolation
text, January 2018
- Ibañez-Azpiroz, Julen; Tsirkin, Stepan S.; Souza, Ivo
- arXiv
Impact of electrodes on the extraction of shift current from a ferroelectric semiconductor SbSI
text, January 2018
- Nakamura, M.; Hatada, H.; Kaneko, Y.
- arXiv
Ultrafast Spin-To-Charge Conversion at the Surface of Topological Insulator Thin Films
text, January 2018
- Wang, Xinbo; Cheng, Liang; Zhu, Dapeng
- arXiv
Theory for shift current of bosons: Photogalvanic spin current in ferrimagnetic and antiferromagnetic insulators
text, January 2019
- Ishizuka, Hiroaki; Sato, Masahiro
- arXiv
Non-equilibrium nature of non-linear optical response: Application to the bulk photo voltaic effect
text, January 2019
- Barik, Tamoghna; Sau, Jay D.
- arXiv
Giant photovoltaic response in band engineered ferroelectric perovskite
journal, May 2018
- Pal, Subhajit; Swain, Atal Bihari; Biswas, Pranab Parimal
- Scientific Reports, Vol. 8, Issue 1