Search results for "WATER SPLITTING"

Yttrium-doped hematite photoanodes for solar water splitting: Photoelectrochemical and electronic properties

2018

Abstract We investigate yttrium-doped hematite thin-film photoelectrochemical properties and find yttrium incorporation to amply improve the performance as a photoanode for water splitting under visible light. We used the spray pyrolysis method to prepare a set of yttrium doped Fe2-xYxO3 (x = 0, 0.05, 0.10, 0.15, 0.2) thin films (thickness below 500 nm) on glass and transparent conductive oxide coated glass slides. Using a substitutional homovalent (Y3+) dopant, the effect on functionality is rationalised as a combined effect on the electronic structure and small polaron mobility from the lattice structure, impurity levels, lattice stability and variance in hybridisation. The photoelectroch…

Electronic and optical properties of pristine, N- and S-doped water-covered TiO2 nanotube surfaces

2019

For rational design and improvement of electronic and optical properties of water-splitting photocatalysts, the ability to control the band edge positions relative to the water redox potentials and the photoresponse as a function of environmental conditions is essential. We combine ab initio molecular dynamics simulations with ab initio many-body theoretical calculations to predict the bandgap and band edge energies, as well as the absorption spectrum of pristine and N- and S-doped TiO2 nanotubes using the DFT+U and G0W0 approaches. Both levels of theory show similar trends, and N+S-codoping appears to be the optimal system for photocatalytic water splitting both in dry and humid conditions…

ZnO/ZnS heterostructures for hydrogen production by photoelectrochemical water splitting

2016

This work studies the photoelectrochemical behavior of novel ZnO/ZnS heterostructures obtained by means of anodization in water and glycerol/water/NH4F electrolytes with different Na2S additions under controlled hydrodynamic conditions. For this purpose different techniques such as Field Emission Scanning Electronic Microscopy (FE-SEM) with EDX, Raman spectroscopy and photoelectrochemical water splitting tests under standard AM 1.5 conditions have been carried out. The obtained results showed that the hydrodynamic conditions promoted an ordered nanotubular morphology which facilitates electron-hole separation and consequently, the photoelectrochemical activity for water splitting is enhance…

Influence of annealing atmosphere on photoelectrochemical response of TiO2 nanotubes anodized under controlled hydrodynamic conditions

2021

[EN] The influence of three annealing atmospheres (air, nitrogen and argon) and the use of controlled hydrodynamic conditions (from 0 to 5000 rpm) on morphological, structural, chemical and photoelectrochemical properties of TiO2 nanotubes have been evaluated. For this purpose, different characterization techniques have been used: Field Emission Scanning Electron Microscopy, Raman Confocal Laser Spectroscopy, X-Ray Diffraction, X-Ray Photoelectron Spectroscopy, Incident Photon-to-electron Conversion Efficiency measurements, ultraviolet-visible absorption spectra, Mott-Schottky analysis and photoelectrochemical water splitting tests. According to the results, it can be concluded that both hy…

Water Dissociation of a Dinuclear Bis(3,5‐dimethylpyrazolyl)methane Copper(II) Complex: X‐ray Diffraction Structure, Magnetic Properties, and Charact…

2018

First-Principles Evaluation of the Morphology of WS2 Nanotubes for Application as Visible-Light-Driven Water-Splitting Photocatalysts

2019

This study was supported by the EC ERA.Net RUS Plus project No. 237 WATERSPLIT as well as Russian Basic Research Foundation No. 16-53-76019. S.K. and E.S. furthermore gratefully acknowledge computing time granted by the Center for Computational Sciences and Simulation (CCSS) of the Universitaẗ Duisburg-Essen and the supercomputer magnitUDE (DFG grants INST 20876/209-1 FUGG, INST 20876/243-1 FUGG) provided by the Zentrum für Informations-und Mediendienste (ZIM). E.S. is also grateful for support by the Cluster of Excellence RESOLV (EXC1069) funded by the Deutsche Forschungsgemeinschaft.

Effect of Reynolds number and lithium cation insertion on titanium anodization

2016

This work studies the influence of using hydrodynamic conditions (Reynolds number, Re = 0 to Re = 600) during Ti anodization and Li+ intercalation on anatase TiO2 nanotubes. The synthesized photocatalysts were characterized by using Field Emission Scanning Electron Microscope (FE-SEM), Raman Confocal Laser Microscopy, Electrochemical Impedance Spectroscopy (EIS), Mott-Schottky analysis (M-S), photoelectrochemical hydrogen production and resistance to photocorrosion tests. The obtained results showed that the conductivity of the NTs increases with Li+ intercalation and Re. The latter is due to the fact that the hydrodynamic conditions eliminate part of the initiation layer formed over the tu…

Structure-Directing and High-Efficiency Photocatalytic Hydrogen Production by Ag Clusters

2014

H2 production by water splitting is hindered mainly by the lack of low-cost and efficient photocatalysts. Here we show that sub-nanometric silver clusters can catalyze the anisotropic growth of gold nanostructures by preferential adsorption at certain crystal planes of Au seeds, with the result that the final nanostructure can be tuned via the cluster/seed ratio. Such semiconducting Ag clusters are extremely stable and retain their electronic structure even after adsorption at the tips of Au nanorods, enabling various photocatalytic experiments, such as oxygen evolution from basic solutions. In the absence of electron scavengers, UV irradiation generates photoelectrons, which are stored wit…

Solution-Processed Ni-Based Nanocomposite Electrocatalysts: An Approach to Highly Efficient Electrochemical Water Splitting

2021

In this study, we report an up-scalable and low-cost solution-processed method to in situ synthesize an earth-abundant non-stoichiometric NiOx-based electrocatalytic film for water oxidation. The catalytic activity was found to be inversely proportional to the baking temperature, which varied from 50 to 500 °C. We found the formation of a hybrid nanocomposite thin film of NiOx nanocrystals (<2 nm size) inside an acetate-based organic matrix at low temperatures (<200 °C). The defective and short-range structural order of the NiOx-based nanocomposite electrocatalysts, compatible with lattice stress, low electrical conductivity, and high density of catalytically active surface species, and hig…

Ni alloy nanowires for alkaline electrolysers

In recent years, the interest towards green hydrogen has drastically increased due to the global decarbonization process. Green hydrogen is obtained by water electrolysis using only electricity from renewable sources. It is considered one of the best storage systems in terms of environmental sustainability but not in economic ones. Nowadays, the research is focused on improving the Alkaline Water Electrolysis (AE) to reduce the cost of production. An approach to improve AE performance is based on nanostructured electrodes characterized by high electrocatalytic activity due to the very high surface area. In fact, the development of more efficient electrolysers with low-cost electrode-electro…