SnO-nanocluster modified anatase TiO2 photocatalyst: exploiting the Sn(ii) lone pair for a new photocatalyst material with visible light absorption and charge carrier separation

TiO2 nanocluster modified-rutile TiO2 photocatalyst: a first principles investigation

(2013) Anna Iwaszuk et al.   Journal of Materials Chemistry A

First-Principles Prediction of New Photocatalyst Materials with Visible-Light Absorption and Improved Charge Separation: Surface Modification of Rutile TiO2 with Nanoclusters of MgO and Ga2O3

(2012) Michael Nolan   ACS Applied Materials & Interfaces

Synthesis of nano-sized anatase TiO2 with reactive {001} facets using lamellar protonated titanate as precursor

(2012) Liuan Gu et al.   CHEMICAL COMMUNICATIONS

A photoactive titanate with a stereochemically active Sn lone pair: Electronic and crystal structure of Sn2TiO4 from computational chemistry

(2012) Lee A. Burton et al.   JOURNAL OF SOLID STATE CHEMISTRY

Detrimental cationic doping of titania in photocatalysis: why chromium Cr3+-doping is a catastrophe for photocatalysis, both under UV- and visible irradiations

(2012) Jean-Marie Herrmann   NEW JOURNAL OF CHEMISTRY

Models of triplet self-trapped excitons in SiO2, HfO2, and HfSiO4

(2012) D. Muñoz Ramo et al.   PHYSICAL REVIEW B

Titanium(IV) Dioxide Surface-Modified with Iron Oxide as a Visible Light Photocatalyst

(2011) Hiroaki Tada et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Nickel(ii) oxide surface-modified titanium(iv) dioxide as a visible-light-active photocatalyst

(2011) Qiliang Jin et al.   CHEMICAL COMMUNICATIONS

Exceptional visible-light-driven photocatalytic activity over BiOBr–ZnFe2O4 heterojunctions

(2011) Liang Kong et al.   CHEMICAL COMMUNICATIONS

Stereochemistry of post-transition metal oxides: revision of the classical lone pair model

(2011) Aron Walsh et al.   CHEMICAL SOCIETY REVIEWS

Heterojunction BiVO4/WO3 electrodes for enhanced photoactivity of water oxidation

(2011) Suk Joon Hong et al.   Energy & Environmental Science

Visible-Light-Active Iron Oxide-Modified Anatase Titanium(IV) Dioxide

(2011) Qiliang Jin et al.   Journal of Physical Chemistry C

Electronic Structure and Reactivity of Ce- and Zr-Doped TiO2: Assessing the Reliability of Density Functional Theory Approaches

(2011) Anna Iwaszuk et al.   Journal of Physical Chemistry C

Analysis of Intrinsic Defects in CeO2 Using a Koopmans-Like GGA+U Approach

(2011) Patrick R. L. Keating et al.   Journal of Physical Chemistry C

Bulk and Surface Polarons in Photoexcited Anatase TiO2

(2011) Cristiana Di Valentin et al.   Journal of Physical Chemistry Letters

Electronic coupling in iron oxide-modified TiO2 leads to a reduced band gap and charge separation for visible light active photocatalysis

(2011) Michael Nolan   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Reactivity of sub 1 nm supported clusters: (TiO2)n clusters supported on rutile TiO2 (110)

(2011) Anna Iwaszuk et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Tin oxide-surface modified anatase titanium(iv) dioxide with enhanced UV-light photocatalytic activity

(2011) Musashi Fujishima et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

SnOx–ZnGa2O4 Photocatalysts with Enhanced Visible Light Activity

(2011) Venkata Bharat Ram Boppana et al.   ACS Catalysis

DFT study of the adsorption of Ni on Anatase (001) surface

(2011) E. Escamilla-Roa et al.   Computational and Theoretical Chemistry

Anatase TiO2 single crystals with exposed {001} and {110} facets: facile synthesis and enhanced photocatalysis

(2010) Min Liu et al.   CHEMICAL COMMUNICATIONS

A facile synthesis of anatase TiO2nanosheets-based hierarchical spheres with over 90% {001} facets for dye-sensitized solar cells

(2010) Weiguang Yang et al.   CHEMICAL COMMUNICATIONS

First-Principles Calculation of Synergistic (N, P)-Codoping Effects on the Visible-Light Photocatalytic Activity of Anatase TiO2

(2010) Run Long et al.   Journal of Physical Chemistry C

The Origin of Visible Light Absorption in Chalcogen Element (S, Se, and Te)-Doped Anatase TiO2 Photocatalysts

(2010) Jian Wei Zheng et al.   Journal of Physical Chemistry C

An Efficient Visible-Light-Sensitive Fe(III)-Grafted TiO2 Photocatalyst

(2010) Huogen Yu et al.   Journal of Physical Chemistry C

One-Step Synthesis of the Nanostructured AgI/BiOI Composites with Highly Enhanced Visible-Light Photocatalytic Performances

(2010) Hefeng Cheng et al.   LANGMUIR

Modeling Localized Photoinduced Electrons in Rutile-TiO2Using Periodic DFT+U Methodology†

(2010) Abdesslem Jedidi et al.   LANGMUIR

A periodic DFT study of water and ammonia adsorption on anatase TiO2 (001) slab

(2010) Rezan Erdogan et al.   SURFACE SCIENCE

Preparation, characterization and visible-light-driven photocatalytic activity of Fe-doped titania nanorods and first-principles study for electronic structures

(2009) Jiaguo Yu et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

Iron(III)-oxo Centers on TiO2for Visible-Light Photocatalysis

(2009) Joseph A. Libera et al.   CHEMISTRY OF MATERIALS

Band gap calculation and photo catalytic activity of rare earths doped rutile TiO2

(2009) Liang BIAN et al.   JOURNAL OF RARE EARTHS

Modelling nano-clusters and nucleation

(2009) C. Richard A. Catlow et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Polaronic trapping of electrons and holes by native defects in anataseTiO2

(2009) Benjamin J. Morgan et al.   PHYSICAL REVIEW B

Design of Narrow-GapTiO2: A Passivated Codoping Approach for Enhanced Photoelectrochemical Activity

(2009) Yanqin Gai et al.   PHYSICAL REVIEW LETTERS

Switching redox site of photocatalytic reaction on titanium(IV) oxide particles modified with transition-metal ion controlled by irradiation wavelength

(2008) Naoya Murakami et al.   APPLIED CATALYSIS A-GENERAL

Titanium dioxide-based semiconductors for solar-driven environmentally friendly applications: impact of point defects on performance

(2008) Janusz Nowotny   Energy & Environmental Science

Structures of Zinc Oxide Nanoclusters: As Found by Revolutionary Algorithm Techniques

(2008) Abdullah A. Al-Sunaidi et al.   Journal of Physical Chemistry C

Microstructure and mechanical properties of stainless steel under Nd:YAG pulsed laser irradiation

(2008) C. Y. Cui et al.   MATERIALS SCIENCE AND TECHNOLOGY

Anatase TiO2 single crystals with a large percentage of reactive facets

(2008) Hua Gui Yang et al.   NATURE

TiO2 photocatalysis and related surface phenomena

(2008) A FUJISHIMA et al.   SURFACE SCIENCE REPORTS