Related references
Note: Only part of the references are listed.Correlation energy from random phase approximations: A reduced density matrices perspective
Katarzyna Pernal
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2018)
Augmented potential, energy densities, and virial relations in the weak- and strong-interaction limits of DFT
Stefan Vuckovic et al.
JOURNAL OF CHEMICAL PHYSICS (2017)
Density Functional Study of Neutral and Charged Silver Clusters Agn with n=2-22. Evolution of Properties and Structure
Michael L. McKee et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2017)
Simple Fully Nonlocal Density Functionals for Electronic Repulsion Energy
Stefan Vuckovic et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2017)
Highly Stable Monocrystalline Silver Clusters for Plasmonic Applications
Sergey M. Novikov et al.
LANGMUIR (2017)
Structural assignment of small cationic silver clusters by far-infrared spectroscopy and DFT calculations
Johan van der Tol et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2017)
Interpolated energy densities, correlation indicators and lower bounds from approximations to the strong coupling limit of DFT
Stefan Vuckovic et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2017)
Structural Evolution of Gold Clusters Aun- (n=21-25) Revisited
Navneet Singh Khetrapal et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2017)
Benchmark Study of Density Functional Theory for Neutral Gold Clusters, Aun (n=2-8)
Heehyun Baek et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2017)
Advances in Gold Catalysis and Understanding the Catalytic Mechanism
Tamao Ishida et al.
CHEMICAL RECORD (2016)
Kinetic-energy-density dependent semilocal exchange-correlation functionals
Fabio Della Sala et al.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2016)
The shell model for the exchange-correlation hole in the strong-correlation limit
Hilke Bahmann et al.
JOURNAL OF CHEMICAL PHYSICS (2016)
Interaction-Strength Interpolation Method for Main-Group Chemistry: Benchmarking, Limitations, and Perspectives
Eduardo Fabiano et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2016)
Exchange-Correlation Functionals via Local Interpolation along the Adiabatic Connection
Stefan Vuckovic et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2016)
Synergism of gold and silver invites enhanced fluorescence for practical applications
Mainak Ganguly et al.
RSC ADVANCES (2016)
Construction of exchange-correlation functionals through interpolation between the non-interacting and the strong-correlation limit
Yongxi Zhou et al.
JOURNAL OF CHEMICAL PHYSICS (2015)
Validation of Methods for Computational Catalyst Design: Geometries, Structures, and Energies of Neutral and Charged Silver Clusters
Kaining Duanmu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2015)
Catalysis by clusters with precise numbers of atoms
Eric C. Tyo et al.
NATURE NANOTECHNOLOGY (2015)
Global Hybrids from the Semiclassical Atom Theory Satisfying the Local Density Linear Response
Eduardo Fabiano et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2015)
Nonscalable Oxidation Catalysis of Gold Clusters
Seiji Yamazoe et al.
ACCOUNTS OF CHEMICAL RESEARCH (2014)
Size- and Structure-specificity in Catalysis by Gold Clusters
Ayako Taketoshi et al.
CHEMISTRY LETTERS (2014)
The power of ion mobility-mass spectrometry for structural characterization and the study of conformational dynamics
Francesco Lanucara et al.
NATURE CHEMISTRY (2014)
Electron avoidance: A nonlocal radius for strong correlation
Lucas O. Wagner et al.
PHYSICAL REVIEW A (2014)
Noble Metal Clusters: Applications in Energy, Environment, and Biology
Ammu Mathew et al.
PARTICLE & PARTICLE SYSTEMS CHARACTERIZATION (2014)
Turbomole
Filipp Furche et al.
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2014)
Accurate ionization potential of gold anionic clusters from density functional theory and many-body perturbation theory
Akhilesh Tanwar et al.
EUROPEAN PHYSICAL JOURNAL B (2013)
Meta-GGA Exchange-Correlation Functional with a Balanced Treatment of Nonlocality
Lucian A. Constantin et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2013)
Accurate Computation of Cohesive Energies for Small to Medium-Sized Gold Clusters
Bun Chan et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2013)
Prediction of Structures and Atomization Energies of Small Silver Clusters, (Ag)n, n < 100
Mingyang Chen et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2013)
Construction of a general semilocal exchange-correlation hole model: Application to nonempirical meta-GGA functionals
Lucian A. Constantin et al.
PHYSICAL REVIEW B (2013)
Electronic structure analysis of small gold clusters Aum (m ≤ 16) by density functional theory
Giuseppe Zanti et al.
THEORETICAL CHEMISTRY ACCOUNTS (2013)
Energy Densities in the Strong-Interaction Limit of Density Functional Theory
Andre Mirtschink et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
Explicitly Correlated Coupled Cluster Calculations for Molecules Containing Group 11 (Cu, Ag, Au) and 12 (Zn, Cd, Hg) Elements: Optimized Complementary Auxiliary Basis Sets for Valence and Core-Valence Basis Sets
J. Grant Hill et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
Multireference Character for 3d Transition-Metal-Containing Molecules
Wanyi Jiang et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
Probing the electronic properties and structural evolution of anionic gold clusters in the gas phase
Lei-Ming Wang et al.
NANOSCALE (2012)
Theoretical study of triatomic silver (Ag3) and its ions with coupled-cluster methods and correlation-consistent basis sets
Ming-Ju Huang et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2012)
Semilocal dynamical correlation with increased localization
Lucian A. Constantin et al.
PHYSICAL REVIEW B (2012)
Size dependent nonlinear optical properties of silver quantum clusters
Sadia Afrin Khan et al.
CHEMICAL PHYSICS LETTERS (2011)
Exchange-correlation generalized gradient approximation for gold nanostructures
E. Fabiano et al.
JOURNAL OF CHEMICAL PHYSICS (2011)
Double-hybrid density-functional theory made rigorous
Kamal Sharkas et al.
JOURNAL OF CHEMICAL PHYSICS (2011)
Structure Determination of Anionic Metal Clusters via Infrared Resonance Enhanced Multiple Photon Electron Detachment Spectroscopy
Marko Haertelt et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2011)
Moller-Plesset perturbation theory: from small molecule methods to methods for thousands of atoms
Dieter Cremer
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2011)
Accurate calculation and modeling of the adiabatic connection in density functional theory
A. M. Teale et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Validation of Density Functional Methods for the Calculation of Small Gold Clusters
Yuan-Kun Shi et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2010)
Probing the Structural Evolution of Medium-Sized Gold Clusters: Aun- (n=27-35)
Nan Shao et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)
Determining the size-dependent structure of ligand-free gold-cluster ions
Detlef Schooss et al.
PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES (2010)
Is size-consistency possible with density functional approximations?
Andreas Savin
CHEMICAL PHYSICS (2009)
A Theoretical Challenge: Transition-Metal Compounds
Markus Reiher
CHIMIA (2009)
Validation study of the ability of density functionals to predict the planar-to-three-dimensional structural transition in anionic gold clusters
Manjeera Mantina et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
The calculation of adiabatic-connection curves from full configuration-interaction densities: Two-electron systems
A. M. Teale et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Electronic Zero-Point Oscillations in the Strong-interaction Limit of Density Functional Theory
Paola Gori-Giorgi et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2009)
Structural and electronic properties of gold microclusters: assessment of the localized Hartree-Fock method
E. Fabiano et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
Structure determination of gold clusters by trapped ion electron diffraction: Au-14(-)-Au-19(-)
Anne Lechtken et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
Workhorse Semilocal Density Functional for Condensed Matter Physics and Quantum Chemistry
John P. Perdew et al.
PHYSICAL REVIEW LETTERS (2009)
Adiabatic connection in the low-density limit
Zhen-Fei Liu et al.
PHYSICAL REVIEW A (2009)
Atomic and electronic structure of gold clusters:: understanding flakes, cages and superatoms from simple concepts
Hannu Hakkinen
CHEMICAL SOCIETY REVIEWS (2008)
Highlights on the recent advances in gold chemistry - a photophysical perspective
Vivian Wing-Wah Yam et al.
CHEMICAL SOCIETY REVIEWS (2008)
Gold - an introductory perspective
Graham J. Hutchings et al.
CHEMICAL SOCIETY REVIEWS (2008)
Theoretical chemistry of gold.: III
Pekka Pyykko
CHEMICAL SOCIETY REVIEWS (2008)
Biomedical applications of small silver clusters
M. Pereiro et al.
JOURNAL OF APPLIED PHYSICS (2008)
2D-3D transition of gold cluster anions resolved
Mikael P. Johansson et al.
PHYSICAL REVIEW A (2008)
Unbiased determination of structural and electronic properties of gold clusters with up to 58 atoms
Yi Dong et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2007)
Strongly emissive individual DNA-encapsulated Ag nanoclusters as single-molecule fluorophores
Tom Vosch et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2007)
Strictly correlated electrons in density-functional theory: A general formulation with applications to spherical densities
Michael Seidl et al.
PHYSICAL REVIEW A (2007)
Size-dependent structural evolution and chemical reactivity of gold clusters
Bokwon Yoon et al.
CHEMPHYSCHEM (2007)
First-principles study of intermediate size silver clusters: Shape evolution and its impact on cluster properties
M. Yang et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Structural evolution of Au nanoclusters: From planar to cage to tubular motifs
Xiaopeng Xing et al.
PHYSICAL REVIEW B (2006)
Experimental structure determination of silver cluster ions (Agn+,19≤n≤79)
Martine N. Blom et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Semiempirical hybrid density functional with perturbative second-order correlation
S Grimme
JOURNAL OF CHEMICAL PHYSICS (2006)
Theoretical chemistry of gold.: II
P Pyykkö
INORGANICA CHIMICA ACTA (2005)
Density functionals for the strong-interaction limit (vol 62, pg 012502, 2000)
M Seidl et al.
PHYSICAL REVIEW A (2005)
Gas-phase kinetics and catalytic reactions of small silver and gold clusters
TM Bernhardt
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2005)
Energy-consistent pseudopotentials for group 11 and 12 atoms: adjustment to multi-configuration Dirac-Hartree-Fock data
D Figgen et al.
CHEMICAL PHYSICS (2005)
Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy
F Weigend et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2005)
Strongly cluster size dependent reaction behavior of CO with O2 on free silver cluster anions
LD Socaciu et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Structure determination of isolated metal clusters via far-infrared spectroscopy
A Fielicke et al.
PHYSICAL REVIEW LETTERS (2004)
Ion mobility spectrometry: a review. Part 1. Structural analysis by mobility measurement
CS Creaser et al.
ANALYST (2004)
Theoretical chemistry of gold
P Pyykko
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2004)
Gold as a novel catalyst in the 21st century: Preparation, working mechanism and applications
M Haruta
GOLD BULLETIN (2004)
Gold nanoparticles: Assembly, supramolecular chemistry, quantum-size-related properties, and applications toward biology, catalysis, and nanotechnology
MC Daniel et al.
CHEMICAL REVIEWS (2004)
Geometrical and electronic structures of gold, silver, and gold-silver binary clusters: Origins of ductility of gold and gold-silver alloy formation
HM Lee et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
On the electronic and atomic structures of small AuN- (N=4-14) clusters:: A photoelectron spectroscopy and density-functional study
H Häkkinen et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2003)
A correlation study of small silver clusters
MN Huda et al.
EUROPEAN PHYSICAL JOURNAL D (2003)
The structures of small gold cluster anions as determined by a combination of ion mobility measurements and density functional calculations
F Furche et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Density functional study of structural and electronic properties of bimetallic silver-gold clusters: Comparison with pure gold and silver clusters
V Bonacic-Koutecky et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Structures of small silver cluster cations (Ag+n, n<12):: ion mobility measurements versus density functional and MP2 calculations
P Weis et al.
CHEMICAL PHYSICS LETTERS (2002)
Dispersed fluorescence spectroscopy of jet-cooled AgAu and Pt2
JC Fabbi et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
A new diagnostic for open-shell coupled-cluster theory
ML Leininger et al.
CHEMICAL PHYSICS LETTERS (2000)
Density functionals for the strong-interaction limit
M Seidl et al.
PHYSICAL REVIEW A (2000)
Ab initio study of the low-lying electronic states of Ag3-, Ag3, and Ag3+:: A coupled-cluster approach
J Yoon et al.
JOURNAL OF CHEMICAL PHYSICS (2000)
Relativistic coupled cluster calculations for neutral and singly charged Au3 clusters
R Wesendrup et al.
JOURNAL OF CHEMICAL PHYSICS (2000)
Simulation of all-order density-functional perturbation theory, using the second order and the strong-correlation limit
M Seidl et al.
PHYSICAL REVIEW LETTERS (2000)
Spectroscopic and mass spectrometric methods for the characterisation of metal clusters
BFG Johnson et al.
COORDINATION CHEMISTRY REVIEWS (2000)