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Vibrational anharmonicity of small gold and silver clusters using the VSCF method

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Outgoing claims: the papers this work cites, builds on, or argues with.

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Variational Approaches to Vibration‐Rotation Spectroscopy for Polyatomic Molecules

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Gold Goes Nano—From Small Clusters to Low‐Dimensional Assemblies

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Theoretical Chemistry of Gold

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Au34−: A Chiral Gold Cluster?

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Car–Parrinello molecular dynamics

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Advanced Fluorescence Reporters in Chemistry and Biology II

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Analytic solutions of the Schrödinger equation for the modified quartic oscillator

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Pseudopotentials for H to Kr optimized for gradient-corrected exchange-correlation functionals

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Theoretical investigation of the ultrafast NeNePo spectroscopy of Au 4 and Ag 4 Clusters

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Matrix Raman spectra of Ag2 and Ag3

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Vibronic spectroscopy of Ag2-Ar

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Excited electronic states of Au3

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A comparative theoretical study of stable geometries and energetic properties of small silver clusters

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Super-matrix methods

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Two computer programs for solving the Schrödinger equation for bound-state eigenvalues and eigenfunctions using the Fourier grid Hamiltonian method

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Improved algorithms for the lowest few eigenvalues and associated eigenvectors of large matrices

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Analysis of the E-X and C-X band system isotopically enriched of Ag2

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Spectroscopic properties of low-lying electronic states of Au2

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Intermetallic Compounds

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An alternative methodology to assess the quality of empirical potentials for small gold clusters

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Theoretical chemistry of gold. II

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Aspects of bonding in small gold clusters

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Low energy structures of gold nanoclusters in the size range 3–38 atoms

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Quantum mechanical treatment of stationary and dynamical properties of bound vibrational systems. Application to the relaxation dynamics of Ag5 after an electron photodetachment

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Non-additive effects in small gold clusters

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Fluorescence and excitation spectra of Ag4 in an argon matrix

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Ab initio study of small gold clusters

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Classical and quantum oscillators of quartic anharmonicities: second-order solution

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Size- and support-dependency in the catalysis of gold

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Tuning Properties in Silver Clusters

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Periodic Properties of Force Constants of Small Transition-Metal and Lanthanide Clusters

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Transferable Scaling Factors for Density Functional Derived Vibrational Force Fields

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Spectroscopic properties of low-lying electronic states of rhodium dimer

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Ab Initio and Improved Empirical Potentials for the Calculation of the Anharmonic Vibrational States and Intramolecular Mode Coupling of N -Methylacetamide

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Oxidation of Small Silver Clusters: A Density Functional Theory Study

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Alloying Effects on the Optical Properties of Ag–Au Nanoclusters from TDDFT Calculations

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The Nature and Role of the Gold–Krypton Interactions in Small Neutral Gold Clusters

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Atomically Precise Arrays of Fluorescent Silver Clusters: A Modular Approach for Metal Cluster Photonics on DNA Nanostructures

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Dopant-induced 2D–3D transition in small Au-containing clusters: DFT-global optimisation of 8-atom Au–Ag nanoalloys

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E.s.r. spectrum of matrix isolated Au3

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Theoretical modeling of optical properties of Ag8 and Ag14 silver clusters embedded in an LTA sodalite zeolite cavity

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Emergence of metallicity in silver clusters in the 150 atom regime: a study of differently sized silver clusters

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Rotational analysis of bands of the gaseous Au2 molecule

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Production et étude du spectre optique de molécules diatomiques de métaux et contribution au calcul théorique des intensités

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Theoretical study of the structure of silver clusters

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Structures of small gold cluster cations (Aun+, n<14): Ion mobility measurements versus density functional calculations

inferredcites →https://doi.org/10.1063/1.1487815openalex-snapshot

Infrared vibronic absorption spectrum and spin–orbit calculations of the upper spin–orbit component of the Au3 ground state

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Density functional study of structural and electronic properties of bimetallic silver–gold clusters: Comparison with pure gold and silver clusters

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The structures of small gold cluster anions as determined by a combination of ion mobility measurements and density functional calculations

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Møller–Plesset perturbation theory for vibrational wave functions

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Fast vibrational self-consistent field calculations through a reduced mode–mode coupling scheme

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Vibrational coupled cluster theory

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Efficient calculation of potential energy surfaces for the generation of vibrational wave functions

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Anharmonic vibrational properties by a fully automated second-order perturbative approach

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Response theory for vibrational wave functions

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Isomers of Au8

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Calculation of vibrational frequencies through a variational reduced-coupling approach

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Fast degenerate correlation-corrected vibrational self-consistent field calculations of the vibrational spectrum of 4-mercaptopyridine

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Exchange-correlation generalized gradient approximation for gold nanostructures

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Self-consistent field energies and wavefunctions for coupled oscillators

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The Fourier grid Hamiltonian method for bound state eigenvalues and eigenfunctions

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Theoretical study of the structures and electron affinities of the dimers and trimers of the group IB metals (Cu, Ag, and Au)

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Ag 5 is a planar trapezoidal molecule

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Relativistic all-electron coupled-cluster calculations on Au2 in the framework of the Douglas–Kroll transformation

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Direct calculation of anharmonic vibrational states of polyatomic molecules using potential energy surfaces calculated from density functional theory

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Relativistic coupled cluster calculations for neutral and singly charged Au3 clusters

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Simplification of the molecular vibration-rotation hamiltonian

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Non-additive forces in atomic clusters

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2D-3D transition of gold cluster anions resolved

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Soft self-consistent pseudopotentials in a generalized eigenvalue formalism

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