scholarly journals Bandgap Engineering of Double Perovskites for One- and Two-photon Water Splitting

2013 ◽  
Vol 1523 ◽  
Author(s):  
Ivano E. Castelli ◽  
Kristian S. Thygesen ◽  
Karsten W. Jacobsen

ABSTRACTComputational screening is becoming increasingly useful in the search for new materials. We are interested in the design of new semiconductors to be used for light harvesting in a photoelectrochemical cell. In the present paper, we study the double perovskite structures obtained by combining 46 stable cubic perovskites which was found to have a finite bandgap in a previous screening-study.1 The four-metal double perovskite space is too large to be investigated completely. For this reason we propose a method for combining different metals to obtain a desired bandgap. We derive some bandgap design rules on how to combine two cubic perovskites to generate a new combination with a larger or smaller bandgap compared with the constituent structures. Those rules are based on the type of orbitals involved in the conduction bands and on the size of the two cubic bandgaps. We also see that a change in the volume has an effect on the size of the bandgap. In addition, we suggest some new candidate materials that can be used as photocatalysts in one- and two-photon water splitting devices.

Author(s):  
Jacob Schneidewind ◽  
Miguel A. Argüello Cordero ◽  
Henrik Junge ◽  
Stefan Lochbrunner ◽  
Matthias Beller

A new mechanism for light-driven water splitting is described, which decreases the reaction's complexity and offers a new way to extend the range of usable wavelengths far into the visible region.


Author(s):  
Junjie Zhu ◽  
Jónína B. Guđmundsdóttir ◽  
Ragnar Strandbakke ◽  
Kevin G. Both ◽  
Thomas Aarholt ◽  
...  

Author(s):  
Lunlun Gong ◽  
Peili Zhang ◽  
Guoquan Liu ◽  
Yu Shan ◽  
Mei Wang

Modification of the surface of semiconductor-based photoelectrodes with molecular redox catalysts gives a way to realize atom-efficient catalysis for photoelectrochemical (PEC) H2 and O2 evolution. However, the diversity of immobilized...


Author(s):  
Bingjun Jin ◽  
Yoonjun Cho ◽  
Cheolwoo Park ◽  
Jeehun Jeong ◽  
Sungsoon Kim ◽  
...  

The photoelectrochemical (PEC) water splitting efficiency is profoundly restricted by the limited light harvesting, rapid charge recombination, and sluggish water oxidation kinetics, in which the construction of a photoelectrode requires...


2018 ◽  
Vol 166 (5) ◽  
pp. H3020-H3028 ◽  
Author(s):  
Tobias A. Kistler ◽  
David Larson ◽  
Karl Walczak ◽  
Peter Agbo ◽  
Ian D. Sharp ◽  
...  

Nano Letters ◽  
2018 ◽  
Vol 18 (2) ◽  
pp. 1118-1123 ◽  
Author(s):  
Sidney E. Creutz ◽  
Evan N. Crites ◽  
Michael C. De Siena ◽  
Daniel R. Gamelin

Nanomaterials ◽  
2020 ◽  
Vol 10 (9) ◽  
pp. 1871
Author(s):  
Yerkin Shabdan ◽  
Aiymkul Markhabayeva ◽  
Nurlan Bakranov ◽  
Nurxat Nuraje

This review focuses on tungsten oxide (WO3) and its nanocomposites as photoactive nanomaterials for photoelectrochemical cell (PEC) applications since it possesses exceptional properties such as photostability, high electron mobility (~12 cm2 V−1 s−1) and a long hole-diffusion length (~150 nm). Although WO3 has demonstrated oxygen-evolution capability in PEC, further increase of its PEC efficiency is limited by high recombination rate of photogenerated electron/hole carriers and slow charge transfer at the liquid–solid interface. To further increase the PEC efficiency of the WO3 photocatalyst, designing WO3 nanocomposites via surface–interface engineering and doping would be a great strategy to enhance the PEC performance via improving charge separation. This review starts with the basic principle of water-splitting and physical chemistry properties of WO3, that extends to various strategies to produce binary/ternary nanocomposites for PEC, particulate photocatalysts, Z-schemes and tandem-cell applications. The effect of PEC crystalline structure and nanomorphologies on efficiency are included. For both binary and ternary WO3 nanocomposite systems, the PEC performance under different conditions—including synthesis approaches, various electrolytes, morphologies and applied bias—are summarized. At the end of the review, a conclusion and outlook section concluded the WO3 photocatalyst-based system with an overview of WO3 and their nanocomposites for photocatalytic applications and provided the readers with potential research directions.


2012 ◽  
Vol 97 (10) ◽  
pp. 1804-1807 ◽  
Author(s):  
C. M. Eggleston ◽  
J. R. Stern ◽  
T. M. Strellis ◽  
B. A. Parkinson

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