Validation study of the ability of density functionals to predict the planar-to-three-dimensional structural transition in anionic gold clusters

The DBH24/08 Database and Its Use to Assess Electronic Structure Model Chemistries for Chemical Reaction Barrier Heights

(2009) Jingjing Zheng et al.   Journal of Chemical Theory and Computation

Ab Initio Study of Thiolate-Protected Au102 Nanocluster

(2008) Yi Gao et al.   ACS Nano

Electronic Structure of Thiolate-Covered Gold Nanoparticles: Au102(MBA)44

(2008) Yan Li et al.   ACS Nano

Catalytically active gold on ordered titania supports

(2008) Mingshu Chen et al.   CHEMICAL SOCIETY REVIEWS

Gold—an introductory perspective

(2008) Graham J. Hutchings et al.   CHEMICAL SOCIETY REVIEWS

Oxide ultra-thin films on metals: new materials for the design of supported metal catalysts

(2008) Hans-Joachim Freund et al.   CHEMICAL SOCIETY REVIEWS

Theoretical chemistry of gold. III

(2008) Pekka Pyykkö   CHEMICAL SOCIETY REVIEWS

Chlorine interaction with defects on the Au(111) surface: A first-principles theoretical investigation

(2008) Thomas A. Baker et al.   JOURNAL OF CHEMICAL PHYSICS

Construction of a generalized gradient approximation by restoring the density-gradient expansion and enforcing a tight Lieb–Oxford bound

(2008) Yan Zhao et al.   JOURNAL OF CHEMICAL PHYSICS

The role of dimensionality on the quenching of spin-orbit effects in the optics of gold nanostructures

(2008) Alberto Castro et al.   JOURNAL OF CHEMICAL PHYSICS

Adsorption of Au and Pd Atoms on Thin SiO2Films:  the Role of Atomic Structure

(2008) M. Baron et al.   Journal of Physical Chemistry C

A Route toward the Generation of Thermally Stable Au Cluster Anions Supported on the MgO Surface

(2008) Gianfranco Pacchioni et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Au Dimers on Thin MgO(001) Films: Flat and Charged or Upright and Neutral?

(2008) V. Simic-Milosevic et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

2D-3D transition of gold cluster anions resolved

(2008) Mikael P. Johansson et al.   PHYSICAL REVIEW A

Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces

(2008) John P. Perdew et al.   PHYSICAL REVIEW LETTERS

Au on (111) and (110) surfaces of CeO2: A density-functional theory study

(2008) Ying Chen et al.   SURFACE SCIENCE

The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06 functionals and 12 other functionals

(2008) Yan Zhao et al.   THEORETICAL CHEMISTRY ACCOUNTS