To use solar irradiation or interior lighting efficiently, we sought a photocatalyst with high reactivity under visible light. Films and powders of TiO 2- x N x have revealed an improvement over titanium dioxide (TiO 2 ) under visible light (wavelength 2 has proven to be indispensable for band-gap narrowing and photocatalytic activity, as assessed by first-principles calculations and x-ray photoemission spectroscopy.

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Visible-Light Photocatalysis in Nitrogen-Doped Titanium Oxides

Titanium Dioxide Nanomaterials: Synthesis, Properties, Modifications, and Applications

[Yang, Hua Gui; Sun, Cheng Hua; Qiao, Shi Zhang; Liu, Gang; Smith, Sean Campbell; Lu, Gao Qing] Univ Queensland, ARC Ctr Excellence Funct Nanomat, Sch Engn, Brisbane, Qld 4072, Australia. [Yang, Hua Gui; Sun, Cheng Hua; Qiao, Shi Zhang; Liu, Gang; Smith, Sean Campbell; Lu, Gao Qing] Univ Queensland, Australian Inst Bioengn & Nanotechnol, Ctr Computat Mol Sci, Brisbane, Qld 4072, Australia. [Zou, Jin] Univ Queensland, Ctr Microscopy & Microanal, Brisbane, Qld 4072, Australia. [Zou, Jin] Univ Queensland, Sch Engn, Brisbane, Qld 4072, Australia. [Liu, Gang; Cheng, Hui Ming] Chinese Acad Sci, Met Res Inst, Shenyang Natl Lab Mat sci, Shenyang 110016, Peoples R China.;Lu, GQ (reprint author), Univ Queensland, ARC Ctr Excellence Funct Nanomat, Sch Engn, Brisbane, Qld 4072, Australia;s.qiao@uq.edu.au maxlu@uq.edu.au

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Anatase TiO(2) single crystals with a large percentage of reactive facets

Fujishima and Honda (1972) demonstrated the potential of titanium dioxide (TiO2) semiconductor materials to split water into hydrogen and oxygen in a photo-electrochemical cell. Their work triggered the development of semiconductor photocatalysis for a wide range of environmental and energy applications. One of the most significant scientific and commercial advances to date has been the development of visible light active (VLA) TiO2 photocatalytic materials. In this review, a background on TiO2 structure, properties and electronic properties in photocatalysis is presented. The development of different strategies to modify TiO2 for the utilization of visible light, including non metal and/or metal doping, dye sensitization and coupling semiconductors are discussed. Emphasis is given to the origin of visible light absorption and the reactive oxygen species generated, deduced by physicochemical and photoelectrochemical methods. Various applications of VLA TiO2, in terms of environmental remediation and in particular water treatment, disinfection and air purification, are illustrated. Comprehensive studies on the photocatalytic degradation of contaminants of emerging concern, including endocrine disrupting compounds, pharmaceuticals, pesticides, cyanotoxins and volatile organic compounds, with VLA TiO2 are discussed and compared to conventional UV-activated TiO2 nanomaterials. Recent advances in bacterial disinfection using VLA TiO2 are also reviewed. Issues concerning test protocols for real visible light activity and photocatalytic efficiencies with different light sources have been highlighted.

/pdf/a-review-on-the-visible-light-active-titanium-dioxide-2qg81s4yao.pdf

A review on the visible light active titanium dioxide photocatalysts for environmental applications

We demonstrate very high efficiency electrophosphorescence in organic light-emitting devices employing a phosphorescent molecule doped into a wide energy gap host. Using bis(2-phenylpyridine)iridium(III) acetylacetonate [(ppy)2Ir(acac)] doped into 3-phenyl-4(1′-naphthyl)-5-phenyl-1,2,4-triazole, a maximum external quantum efficiency of (19.0±1.0)% and luminous power efficiency of (60±5) lm/W are achieved. The calculated internal quantum efficiency of (87±7)% is supported by the observed absence of thermally activated nonradiative loss in the photoluminescent efficiency of (ppy)2Ir(acac). Thus, very high external quantum efficiencies are due to the nearly 100% internal phosphorescence efficiency of (ppy)2Ir(acac) coupled with balanced hole and electron injection, and triplet exciton confinement within the light-emitting layer.

Nearly 100% internal phosphorescence efficiency in an organic light emitting device

One of the keys to highly efficient phosphorescent emission in organic light-emitting devices is to confine triplet excitons generated within the emitting layer. We employ “starburst” perfluorinated phenylenes (C60F42) as a both hole- and exciton-block layer, and a hole-transport material 4,4′,4″-tri(N-carbazolyl) triphenylamine as a host for the phosphorescent dopant dye in the emitting layer. A maximum external quantum efficiency reaches to 19.2%, and keeps over 15% even at high current densities of 10–20 mA/cm2, providing several times the brightness of fluorescent tubes for lighting. The onset voltage of the electroluminescence is as low as 2.4 V and the peak power efficiency is 70–72 lm/W, promising for low-power display devices.

Highly efficient phosphorescence from organic light-emitting devices with an exciton-block layer

First-principles calculations using the full-potential linearized augmented plane-wave method have been performed to investigate detailed electronic and optical properties of ${\mathrm{TiO}}_{2}$ in the anatase structure. The fully optimized structure, obtained by minimizing the total energy and atomic forces, are in good agreement with experiment. Stabilization of the structure by the trade off between a favorable coordination in the ${\mathrm{sp}}^{2}$ hybridization and the Coulomb repulsion among oxygen atoms is also demonstrated. We calculate band structure, densities of states and charge densities, and interpret their features in terms of the bonding structure in the molecular orbital picture. The optical properties, calculated within the dipole approximation, are found to agree with recent experiments on single crystals of anatase ${\mathrm{TiO}}_{2}.$ Near the absorption edge, the results show a significant optical anisotropy in the components parallel and perpendicular to the c axis. We demonstrate that this large dichroism results from the existence of nonbonding ${d}_{\mathrm{xy}}$ orbitals located at the bottom of the conduction bands, which allows direct dipole transitions dominantly for the perpendicular component.

Electronic and optical properties of anatase TiO 2

TiO2-based powder, including 0.1 at% of N doped in the rutile lattice, has been synthesized by oxidation of TiN. As a result, a significant shift of the absorption edge to a lower energy in the visible-light region has been observed. The substitutional doping of N into the TiO2 lattice is found to be effective; its 2p states contribute to the band-gap narrowing by mixing with O 2p as shown in ab initio electronic structure calculations.

https://iopscience.iop.org/article/10.1143/JJAP.40.L561/pdf

Band-Gap Narrowing of Titanium Dioxide by Nitrogen Doping

Band-Gap Narrowing of Titanium Dioxide by Nitrogen Doping : Optical Properties of Condensed Matter

We demonstrate that by using thin films of metal oxides, such as vanadium oxide (VOx), molybdenum oxide (MoOx) and ruthenium oxide (RuOx), as a hole-injecting layer for an organic electroluminescent (EL) device consisting of N,N'-diphenyl-N,N-bis(3-methylphenyl1)1,1'-biphenyl-4,4' diamine (TPD) and tris-(8-quinolinolato) aluminium (Alq), the EL device performance can be significantly improved. The `operating voltage' of the device is reduced with respect to a device with a well known indium - tin-oxide (ITO) electrode for hole injection. We consider that the improvement of the operating voltage is attributable to the lower energy barrier for hole injection at the metal oxide/TPD interface.

https://iopscience.iop.org/article/10.1088/0022-3727/29/11/004/pdf

Yasunori Taga

Papers

Highly efficient phosphorescence from organic light-emitting devices with an exciton-block layer

Electronic and optical properties of anatase TiO 2

Band-Gap Narrowing of Titanium Dioxide by Nitrogen Doping

Band-Gap Narrowing of Titanium Dioxide by Nitrogen Doping : Optical Properties of Condensed Matter

Metal oxides as a hole-injecting layer for an organic electroluminescent device