Adsorption of Proline and Glycine on the TiO2(110) Surface: A Density Functional Theory Study

A systematic study of the influence of the slab thickness on the Lewis acidity of the rutile (110) surface: A quantum-mechanical simulation of CO adsorption

(2009) Jessica Scaranto et al.   CHEMICAL PHYSICS LETTERS

The Influence of Charge Transport and Recombination on the Performance of Dye-Sensitized Solar Cells

(2009) Mingkui Wang et al.   CHEMPHYSCHEM

Imaging Hindered Rotations of Alkoxy Species on TiO2(110)

(2009) Zhenrong Zhang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Adsorption structure of glycine on TiO2(110): A photoelectron diffraction determination

(2009) T.J. Lerotholi et al.   SURFACE SCIENCE

Chemical reactions on rutile TiO2(110)

(2008) Chi Lun Pang et al.   CHEMICAL SOCIETY REVIEWS

VESTA: a three-dimensional visualization system for electronic and structural analysis

(2008) Koichi Momma et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Structural and Electronic Properties of Selected Rutile and Anatase TiO2Surfaces:  An ab Initio Investigation

(2008) Frédéric Labat et al.   Journal of Chemical Theory and Computation

Ab-initiosimulations of materials using VASP: Density-functional theory and beyond

(2008) Jürgen Hafner   JOURNAL OF COMPUTATIONAL CHEMISTRY

Stabilization of Zwitterionic Structures of Amino Acids (Gly, Ala, Val, Leu, Ile, Ser and Pro) by Ammonium Ions in the Gas Phase

(2008) Ronghu Wu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The adsorption and reactions of the amino acid proline on rutile TiO2(110) surfaces

(2008) G.J. Fleming et al.   SURFACE SCIENCE

Ab Initio Study of Surface Acid−Base Reactions. The Case of Molecular and Dissociative Adsorption of Ammonia on the (011) Surface of Rutile TiO2

(2007) P. R. McGill et al.   LANGMUIR