Related references
Note: Only part of the references are listed.Solar Water Splitting: Progress Using Hematite (alpha-Fe2O3) Photoelectrodes
Kevin Sivula et al.
CHEMSUSCHEM (2011)
Probing the photoelectrochemical properties of hematite (α-Fe2O3) electrodes using hydrogen peroxide as a hole scavenger
Hen Dotan et al.
ENERGY & ENVIRONMENTAL SCIENCE (2011)
Visible light-driven water oxidation-from molecular catalysts to photoelectrochemical cells
Lele Duan et al.
ENERGY & ENVIRONMENTAL SCIENCE (2011)
Parallel Implementation of Γ-Point Pseudopotential Plane-Wave DFT with Exact Exchange
Eric J. Bylaska et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2011)
Thermodynamic theory of multi-electron transfer reactions: Implications for electrocatalysis
Marc T. M. Koper
JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2011)
Electronic Structure of Partially Reduced Rutile TiO2(110) Surface: Where Are the Unpaired Electrons Located?
Steeve Chretien et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2011)
Influence of Plasmonic Au Nanoparticles on the Photoactivity of Fe2O3 Electrodes for Water Splitting
Elijah Thimsen et al.
NANO LETTERS (2011)
A multifaceted approach to hydrogen storage
Andrew J. Churchard et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Simulation of surface processes
Hannes Jonsson
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2011)
A surface science perspective on TiO2 photocatalysis
Michael A. Henderson
SURFACE SCIENCE REPORTS (2011)
Passivating surface states on water splitting hematite photoanodes with alumina overlayers
Florian Le Formal et al.
CHEMICAL SCIENCE (2011)
Controlling Photoactivity in Ultrathin Hematite Films for Solar Water-Splitting
Florian Le Formal et al.
ADVANCED FUNCTIONAL MATERIALS (2010)
Light-Induced Water Splitting with Hematite: Improved Nanostructure and Iridium Oxide Catalysis
S. David Tilley et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2010)
The Mechanism of Water Oxidation: From Electrolysis via Homogeneous to Biological Catalysis
Holger Dau et al.
CHEMCATCHEM (2010)
Solar Water Splitting Cells
Michael G. Walter et al.
CHEMICAL REVIEWS (2010)
Solar Energy Supply and Storage for the Legacy and Non legacy Worlds
Timothy R. Cook et al.
CHEMICAL REVIEWS (2010)
Preferential Orientation in Hematite Films for Solar Hydrogen Production via Water Splitting
Maurin Cornuz et al.
CHEMICAL VAPOR DEPOSITION (2010)
Bimetallic Ru Electrocatalysts for the OER and Electrolytic Water Splitting in Acidic Media
Rhys Forgie et al.
ELECTROCHEMICAL AND SOLID STATE LETTERS (2010)
The oxygen reduction reaction mechanism on Pt(111) from density functional theory calculations
Vladimir Tripkovic et al.
ELECTROCHIMICA ACTA (2010)
A framework for visible-light water splitting
Rufino M. Navarro et al.
ENERGY & ENVIRONMENTAL SCIENCE (2010)
Composite photoanodes for photoelectrochemical solar water splitting
Jianwei Sun et al.
ENERGY & ENVIRONMENTAL SCIENCE (2010)
Recent advances in nanoelectrode architecture for photochemical hydrogen production
Hyung Gyu Park et al.
ENERGY & ENVIRONMENTAL SCIENCE (2010)
Examining architectures of photoanode-photovoltaic tandem cells for solar water splitting
Jeremie Brillet et al.
JOURNAL OF MATERIALS RESEARCH (2010)
Cluster Study of the Photo-Oxidation of Water on Rutile Titanium Dioxide (TiO2)
A. Valdes et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2010)
Photoelectrochemical Water Oxidation by Cobalt Catalyst (Co-Pi)/α-Fe2O3 Composite Photoanodes: Oxygen Evolution and Resolution of a Kinetic Bottleneck
Diane K. Zhong et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)
Photoelectrochemical Water Splitting with Mesoporous Hematite Prepared by a Solution-Based Colloidal Approach
Kevin Sivula et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)
Decoupling Feature Size and Functionality in Solution-Processed, Porous Hematite Electrodes for Solar Water Splitting
Jeremie Brillet et al.
NANO LETTERS (2010)
Electrochemical chlorine evolution at rutile oxide (110) surfaces
Heine A. Hansen et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
Charge Localization Dynamics Induced by Oxygen Vacancies on the TiO2(110) Surface
Piotr M. Kowalski et al.
PHYSICAL REVIEW LETTERS (2010)
Reflective properties of nanoparticle-arrayed surfaces
Bo-Tau Liu et al.
THIN SOLID FILMS (2010)
WO3-Fe2O3 Photoanodes for Water Splitting: A Host Scaffold, Guest Absorber Approach
Kevin Sivula et al.
CHEMISTRY OF MATERIALS (2009)
First principles study of the photo-oxidation of water on tungsten trioxide (WO3)
A. Valdes et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
The DBH24/08 Database and Its Use to Assess Electronic Structure Model Chemistries for Chemical Reaction Barrier Heights
Jingjing Zheng et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2009)
A New Family of Heterofullerenes: Stoichiometric TiO2 Nanoclusters
Dongju Zhang et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Recent Advances in the Use of TiO2 Nanotube and Nanowire Arrays for Oxidative Photoelectrochemistry
Karthik Shankar et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Oxygen evolution on Ru1-xNixO2-y nanocrystalline electrodes
Katerina Macounova et al.
JOURNAL OF SOLID STATE ELECTROCHEMISTRY (2009)
Combinatorial Study of High-Surface-Area Binary and Ternary Electrocatalysts for the Oxygen Evolution Reaction
K. C. Neyerlin et al.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2009)
Formation energies of rutile metal dioxides using density functional theory
J. I. Martinez et al.
PHYSICAL REVIEW B (2009)
The effect of Pt on the photocatalytic degradation pathway of methylene blue over TiO2 under ambient conditions
Zhiqiang Yu et al.
APPLIED CATALYSIS B-ENVIRONMENTAL (2008)
Inorganic materials as catalysts for photochemical splitting of water
Frank E. Osterloh
CHEMISTRY OF MATERIALS (2008)
Influence of Oxygen on Reactivity of Ru(1-x)Fe(x)O(2-y)-Doped Materials
Katerina Macounova et al.
ELECTROCHEMICAL AND SOLID STATE LETTERS (2008)
Solar hydrogen production with nanostructured metal oxides
Roe van de Krol et al.
JOURNAL OF MATERIALS CHEMISTRY (2008)
Metal oxide photoanodes for solar hydrogen production
Bruce D. Alexander et al.
JOURNAL OF MATERIALS CHEMISTRY (2008)
Oxidation and photo-oxidation of water on TiO2 surface
A. Valdes et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2008)
Surface Pourbaix diagrams and oxygen reduction activity of Pt, Ag and Ni(111) surfaces studied by DFT
Heine A. Hansen et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2008)
Structural, electronic, and surface properties of anatase TiO2 nanocrystals from first principles
Amilcare Iacomino et al.
PHYSICAL REVIEW B (2008)
Time-dependent density-functional theory with a self-interaction correction
J. Messud et al.
PHYSICAL REVIEW LETTERS (2008)
Orbital-dependent density functionals: Theory and applications
Stephan Kummel et al.
REVIEWS OF MODERN PHYSICS (2008)
Theoretical study of stable, defect-free (TiO2)n nanoparticles with n=10-16
Zheng-Wang Qu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2007)
Electrolysis of water on oxide surfaces
J. Rossmeisl et al.
JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2007)
Dye-sensitization of the TiO2 rutile (110) surface by perylene dyes:: Quantum-chemical periodic B3LYP computations
Mattias Nilsing et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2007)
New benchmark for water photooxidation by nanostructured α-Fe2O3 films
Andreas Kay et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)
DFT study of bare and dye-sensitized TiO2 clusters and nanocrystals
Maria J. Lundqvist et al.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2006)
Theoretical study of adsorption of O(3P) and H2O on the rutile TiO2(110) surface
Zheng-wang Qu et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
Theoretical study of the electronic structure and stability of titanium dioxide clusters (TiO2)n with n=1-9
ZW Qu et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
Pd diffusion on MgO(100):: The role of defects and small cluster mobility
LJ Xu et al.
SURFACE SCIENCE (2006)
Electrolysis of water on (oxidized) metal surfaces
J Rossmeisl et al.
CHEMICAL PHYSICS (2005)
Structure and stability of small TiO2 nanoparticles
S Hamad et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Molecular design of squaraine dyes for efficient far-red and near-IR sensitization of solar cells
C Li et al.
CHEMISTRY LETTERS (2005)
Origin of the overpotential for oxygen reduction at a fuel-cell cathode
JK Norskov et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Photo-electrochemical hydrogen generation from water using solar energy. Materials-related aspects
T Bak et al.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY (2002)
Improving difficult reaction barriers with self-interaction corrected density functional theory
S Patchkovskii et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Curing difficult cases in magnetic properties prediction with self-interaction corrected density functional theory
S Patchkovskii et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
Enhanced photocurrent in thin film TiO2 electrodes prepared by sol-gel method
M Takahashi et al.
THIN SOLID FILMS (2001)
Hole trapping at Al impurities in silica: A challenge for density functional theories
J Laegsgaard et al.
PHYSICAL REVIEW LETTERS (2001)
Theoretical description of hole localization in a quartz Al center: The importance of exact electron exchange
G Pacchioni et al.
PHYSICAL REVIEW B (2001)
A climbing image nudged elastic band method for finding saddle points and minimum energy paths
G Henkelman et al.
JOURNAL OF CHEMICAL PHYSICS (2000)
Improving the photoelectrochemical performance of nanostructured TiO2 films by adsorption of gold nanoparticles
N Chandrasekharan et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2000)
Photolelectrochemistry of nanostructured WO3 thin film electrodes for water oxidation:: Mechanism of electron transport
HL Wang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2000)