Assessing capability of semiconductors to split water using ionization potentials and electron affinities only

Band-structure calculations for the 3dtransition metal oxides inGW

(2013) Stephan Lany   PHYSICAL REVIEW B

Electronic and optical properties of CoX2O4 (X = Al, Ga, In) alloys

(2012) Chunbao Feng et al.   APPLIED PHYSICS LETTERS

New cubic perovskites for one- and two-photon water splitting using the computational materials repository

(2012) Ivano E. Castelli et al.   Energy & Environmental Science

First principles high throughput screening of oxynitrides for water-splitting photocatalysts

(2012) Yabi Wu et al.   Energy & Environmental Science

Ionization energy of atoms obtained from GW self-energy or from random phase approximation total energies

(2012) Fabien Bruneval   JOURNAL OF CHEMICAL PHYSICS

Correcting density functional theory for accurate predictions of compound enthalpies of formation: Fitted elemental-phase reference energies

(2012) Vladan Stevanović et al.   PHYSICAL REVIEW B

Computational screening of perovskite metal oxides for optimal solar light capture

(2011) Ivano E. Castelli et al.   Energy & Environmental Science

Reactive magnetron sputtering of Cu2O: Dependence on oxygen pressure and interface formation with indium tin oxide

(2011) Jonas Deuermeier et al.   JOURNAL OF APPLIED PHYSICS

Z-scheme photocatalyst systems for water splitting under visible light irradiation

(2011) Akihiko Kudo   MRS BULLETIN

Recent developments in solar water-splitting photocatalysis

(2011) Frank E. Osterloh et al.   MRS BULLETIN

Tuning Semiconductor Band Edge Energies for Solar Photocatalysis via Surface Ligand Passivation

(2011) Shenyuan Yang et al.   NANO LETTERS

Two-dimensional electron gas with universal subbands at the surface of SrTiO3

(2011) A. F. Santander-Syro et al.   NATURE

Plasmonic-metal nanostructures for efficient conversion of solar to chemical energy

(2011) Suljo Linic et al.   NATURE MATERIALS

First principles scheme to evaluate band edge positions in potential transition metal oxide photocatalysts and photoelectrodes

(2011) Maytal Caspary Toroker et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Doping properties of monoclinic BiVO4studied by first-principles density-functional theory

(2011) Wan-Jian Yin et al.   PHYSICAL REVIEW B

Prediction of semiconductor band edge positions in aqueous environments from first principles

(2011) Yabi Wu et al.   PHYSICAL REVIEW B

Solar Water Splitting Cells

(2010) Michael G. Walter et al.   CHEMICAL REVIEWS

Band structure engineering of semiconductors for enhanced photoelectrochemical water splitting: The case ofTiO2

(2010) Wan-Jian Yin et al.   PHYSICAL REVIEW B

pH-dependent surface charging and points of zero charge. IV. Update and new approach

(2009) Marek Kosmulski   JOURNAL OF COLLOID AND INTERFACE SCIENCE

Surface potentials of magnetron sputtered transparent conducting oxides

(2009) A. Klein et al.   THIN SOLID FILMS

Dielectric properties and excitons for extended systems from hybrid functionals

(2008) Joachim Paier et al.   PHYSICAL REVIEW B

Band Offsets at theSi/SiO2Interface from Many-Body Perturbation Theory

(2008) R. Shaltaf et al.   PHYSICAL REVIEW LETTERS

In Situ Formation of an Oxygen-Evolving Catalyst in Neutral Water Containing Phosphate and Co2+

(2008) M. W. Kanan et al.   SCIENCE

Inorganic Materials as Catalysts for Photochemical Splitting of Water

(2007) Frank E. Osterloh   CHEMISTRY OF MATERIALS