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Titanium-based oxides are abundant, chemically stable, non-toxic, and highly versatile materials, with applications ranging from photovoltaics to catalysis. For rutile and anatase phases of Titanium dioxide (TiO2), the bandgap ranges from…

Materials Science · Physics 2022-01-04 Lynet Allan , George O Amolo , Julius Mwabora , Silas Mureramanzi

TiO2 is a wide band-gap semiconductor that has been intensively investigated for photocatalysis and water-spiting. However, weak light absorption in the visible region of the spectrum poses stringent limitation to its practical application.…

Materials Science · Physics 2023-02-07 Fernando P. Sabino , Anderson Janotti

Among the wide bandgap semiconductors, TiO$_{2}$ is the highly stable and cost-efficient semiconductor used for the different photocatalysis processes like water splitting, chemical waste degradation, anti-micro bacterial activities, and…

Materials Science · Physics 2022-07-27 Manish K Vishwakarma , Manjeet , Puneet Jain

Visible-light photocatalyst titanium dioxide (TiO2) was successfully prepared via a novel and facile single-mode microwave assisted synthesis process. In this one-step synthesis, Ti as target material selectively oxides in magnetic field…

Applied Physics · Physics 2022-02-04 Kunihiko Katoa , Sebastien Vaucher , Patrik Hoffmann , Yunzi Xin , Takashi Shirai

Black TiO2 with/without noble metal has been proposed for visible photocatalyst, still leaving poor catalyst efficiency. Alternatively, phase-mixed TiO2 such as anatase and rutile has been commonly used for visible catalysts with the…

Zr/N co-doped TiO2 nanostructures were successfully synthesized using nanotubular titanic acid (NTA) as precursors by a facile wet chemical route and subsequent calcination. These Zr/N-doped TiO2 nanostructures made by NTA precursors show…

Materials Science · Physics 2013-12-31 Min Zhang , Xinluan Yu , Dandan Lu , Jianjun Yang

Titanium dioxide is one of the most widely investigated oxides. This is due to its broad range of applications, from catalysis to photocatalysis to photovoltaics. Despite this large interest, many of its bulk properties have been sparsely…

Materials Science · Physics 2010-03-12 L. Chiodo , J. M. García-Lastra , D. J. Mowbray , A. Iacomino , A. Rubio

Titanium dioxide is a photocatalytic substance of great practical importance. However, with its bandgap in the ultraviolet (UV) regime, native forms (undoped) of TiO2 generally exhibits poor photocatalytic activities under visible light.…

Chemical Physics · Physics 2013-12-04 Mingzheng Wang , Ka-Kit Yee , Biao Nie , Hua Cheng , Jian Lu , Linbao Luo , Zhengtao Xu , Yang Yang Li

Titanium dioxide (TiO2) is a wide band gap semiconducting material which is promising for photocatalysis. Here we present first-principles calculations to study the pressure dependence of structural and electronic properties of two TiO2…

Materials Science · Physics 2017-06-21 Yong Yang

TiO$_2$ and SrTiO$_3$ are well known materials in the field of photocatalysis due to their exceptional electronic structure, high chemical stability, non-toxicity and low cost. However, owing to the wide band gap, these can be utilized only…

Materials Science · Physics 2020-09-25 Manish Kumar , Pooja Basera , Shikha Saini , Saswata Bhattacharya

Understanding the mechanism of the heterojunction is an important step towards controllable and tunable interfaces for photocatalytic and photovoltaic based devices. To this aim, we propose a thorough study of a double heterostructure…

Computational Physics · Physics 2019-04-04 Slimane Haffad

Systematic investigation of atomic structure of N-ion implanted TiO2 (thin films and bulk ceramics) was performed by XPS measurements (core levels and valence bands) and first-principles density functional theory (DFT) calculations. In bulk…

The formation of (TiO2)x(Cu2O)y solid-solutions are investigated using a global optimization evolutionary algorithm. First-principles calculations based on density functional theory are then used to gain insight into the electronic…

Materials Science · Physics 2013-03-15 Heng-Rui Liu , Ji-Hui Yang , Yue-Yu Zhang , Shiyou Chen , Aron Walsh , Hongjun Xiang , Xingao Gong , Su-Huai Wei

Samples of nitrogen-doped titanium dioxide (anatase, $0.2 \leq N \leq 1.0~wt\%$) prepared by the sol-gel method were investigated using X-band EPR spectroscopy, photoconductivity and photocatalysis measurements. $N\bullet$ and $NO\bullet$…

Materials Science · Physics 2017-04-18 A. A. Minnekhanov , N. T. Le , E. A. Konstantinova , P. K. Kashkarov

Photocatalytic water splitting has attracted considerable attention for renewable energy production. Since the first reported photocatalytic water splitting by titanium dioxide, this material remains one of the most promising…

Materials Science · Physics 2026-03-24 Marija Stojkovic , Edward Linscott , Nicola Marzari

Due to their characteristic geometry, TiO$_2$ nanotubes (TNTs), suitably doped by metal-substitution to enhance their photocatalytic properties, have a high potential for applications such as clean fuel production. In this context, we…

Materials Science · Physics 2020-09-17 Mohamed M. Fadlallah , Ulrich Eckern

Nanostructures of Titanium oxide (TiO2) are being studied for many promising applications, e.g., solar photovoltaics, solar water splitting for H2 fuel generation etc., due to their excellent photo-catalytic properties. We have synthesized…

Materials Science · Physics 2016-09-30 Gangadhar Das , Manoj Kumar , A. K. Biswas , Ajay Khooha , Puspen Mondal , M. K. Tiwari

We present the GGA+U calculations to investigate the electronic structure and visible light absorption of the N, B-codoped anatase TiO2. The NsBi (substitutional N, interstitial B) codoped TiO2 produces significant Ti 3d and N 2p mid-gap…

Materials Science · Physics 2015-08-10 Meili Guo , Xiao-Dong Zhang , Jiulin Du

In the present work we investigate the photocatalytic hydrogen production (water splitting) activity of different Pt loaded TiO2 nanotube layers. Therefore, we fabricate free standing membranes and fix them in four different configurations:…

Materials Science · Physics 2016-10-14 Gihoon Cha , Kiyoung Lee , JeongEun Yoo , Manuela S. Killian , Patrik Schmuki

We demonstrate waveguide-coupled titanium dioxide (TiO2) racetrack resonators with loaded quality factors of 2x10^4 for the visible wavelengths. The structures were fabricated in sputtered TiO2 thin films on oxidized silicon substrates…

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