Enhancing Solar-Driven Water Splitting with Surface-Engineered Nanostructures Shaohua Shen,* Sarah A. Lindley, Chung-Li Dong, Eefei Chen, Ying-Rui Lu, Jigang Zhou, Yongfeng Hu, Damon A. Wheeler, Penghui Guo, Jin Z. Zhang, David S. Kliger, and Samuel S. Mao Functional nanoscale interfaces that promote the transport of photoexcited charge carriers are fundamental to efficient hydrogen production during photoelectrochemical (PEC) splitting of water. Here, the realization of a functional one-dimensional nanostructure achieved through surface engineer- ing of hematite (α-Fe 2 O 3 ) nanorods with a TiO 2 overlayer is reported. The surface-engineered hematite nanostructure exhibits significantly improved PEC performance as compared to untreated α-Fe 2 O 3 , with an increase in the maximum incident photon-to-current efficiency (IPCE) of nearly 400% at 350 nm. While addition of the TiO 2 overlayer did not alter the lifetime of photoexcited charge carriers, as evidenced from transient absorption spec- troscopy, it is found that the presence of TiO 2 could enhance oxygen electrocatalysis by interfacial electron enrichment, largely attributed to enhanced O(2p)Fe(3d) hybridization. Moreover, the interfacial electronic structure revealed from XANES measurements of the α-Fe 2 O 3 /TiO 2 nanorods suggests that photoexcited holes in α-Fe 2 O 3 may efficiently transfer through the TiO 2 overlayer to the electrolyte while electrons migrate to the external circuit along the one-dimensional nanorods, thereby promoting charge separation and enhancing PEC splitting of water. 1. Introduction Hematite (α-Fe 2 O 3 ) has been considered as a promising photoelectrode material for solar water splitting due to its stability, non-toxicity, and earth-abundance. [14] Although the bandgap of hematite (1.92.2 eV) is favorable for efcient utilization of the majority of solar photons, the solar-to-chemical energy con- version efciency achieved so far [13] is signicantly lower than that predicted by theory in an ideal tandem photoelectrochem- ical (PEC) conguration (up to 16%). [5] A number of factors are responsible for the limited PEC performance of α-Fe 2 O 3 , includ- ing short hole diffusion length, fast charge recombination dynamics, and sluggish oxy- gen evolution kinetics. [1,6] In order to promote charge transfer and charge separation of photogenerated car- riers, numerous studies have focused on improving the conductivity of α-Fe 2 O 3. Doping has been a common approach, using metals like Ti, Zr, Sn, Si, and Pt as electron donors to enhance electrical Prof. S. Shen, P. Guo International Research Center for Renewable Energy State Key Laboratory of Multiphase Flow in Power Engineering Xian Jiaotong University Shaanxi 710049, China E-mail: shshen_xjtu@mail.xjtu.edu.cn S. A. Lindley, E. Chen, Dr. D. A. Wheeler, Prof. J. Z. Zhang, Prof. D. S. Kliger Department of Chemistry and Biochemistry University of California at Santa Cruz Santa Cruz, CA 95064, United States Prof. C.-L. Dong, Y.-R. Lu Department of Physics Tamkang University 151 Yingzhuan Road, New Taipei City 25137, Taiwan Prof. J. Zhou, Prof. Y. Hu Canadian Light Sources Inc. 44 Innovation Boulevard, Saskatoon, S7N 2V7, Canada The ORCID identification number(s) for the author(s) of this article can be found under https://doi.org/10.1002/solr.201800285. DOI: 10.1002/solr.201800285 Prof. S. S. Mao Department of Mechanical Engineering University of California at Berkeley Berkeley, CA 94720, United States Solar-Driven Water Splitting www.solar-rrl.com FULL PAPER Sol. RRL 2018, 1800285 © 2018 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim 1800285 (1 of 12)