Structural evolution of small gold clusters doped by one and two boron atoms

Exploring the Potential Energy Surface of E2P4Clusters (E=Group 13 Element): The Quest for Inverse Carbon-Free Sandwiches

(2014) Abril C. Castro et al.   CHEMISTRY-A EUROPEAN JOURNAL

DFT and QTAIM studies on structure and stability of beryllium doped gold clusters

(2014) Debajyoti Bhattacharjee et al.   Computational and Theoretical Chemistry

The performance of density functional and wavefunction-based methods for 2D and 3D structures of Au10

(2013) Daniel A. Götz et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Boron as intruder in planar gold clusters. How does its presence modify reactivity?

(2013) Yanet Romero et al.   Computational and Theoretical Chemistry

Density-functional investigation of the geometries, stabilities, electronic, and magnetic properties of gold cluster anions doped with aluminum: (1⩽n⩽8)

(2012) Chen-Ju Wang et al.   Computational and Theoretical Chemistry

Catalytic Activities of Subnanometer Gold Clusters (Au16–Au18, Au20, and Au27–Au35) for CO Oxidation

(2011) Yi Gao et al.   ACS Nano

An Ab initio theoretical investigation on the geometrical and electronic structures of BAun−/0 (n = 1-4) clusters

(2011) Da-Zhi Li et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Rational Design of Small 3D Gold Clusters

(2011) Alina P. Sergeeva et al.   JOURNAL OF CLUSTER SCIENCE

The electrostatic potential: an overview

(2011) Jane S. Murray et al.   Wiley Interdisciplinary Reviews-Computational Molecular Science

Bridging gold: B-Au-B three-center-two-electron bonds in electron-deficient B2Aun−/0 (n = 1, 3, 5) and mixed analogues

(2010) Wen-Zhi Yao et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Size Matters, but Is Being Planar of Any Relevance? Electron Donor−Acceptor Properties of Neutral Gold Clusters up to 20 Atoms

(2010) Ana Martínez   Journal of Physical Chemistry C

A systematic search for minimum structures of small gold clusters Au[sub n] (n=2–20) and their electronic properties

(2009) Behnam Assadollahzadeh et al.   JOURNAL OF CHEMICAL PHYSICS

2D−3D Transition for Cationic and Anionic Gold Clusters: A Kinetic Energy Density Functional Study

(2009) Lara Ferrighi et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Structural and electronic properties of stable Aun (n=2–13) clusters: A density functional study

(2008) Ajanta Deka et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

Deciphering Chemical Bonding in Golden Cages

(2008) Dmitry Yu. Zubarev et al.   JOURNAL OF PHYSICAL CHEMISTRY A

”Developing paradigms of chemical bonding: adaptive natural density partitioning

(2008) Dmitry Yu. Zubarev et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Identification of Active Gold Nanoclusters on Iron Oxide Supports for CO Oxidation

(2008) A. A. Herzing et al.   SCIENCE