Research Catalog

Title

Dynamics of molecule surface interactions / Gert D. Billing.

Author

Billing, Gert D.

Publication

New York : Wiley, ©2000.

Items in the Library & Off-site

Details

Description

xii, 235 pages : illustrations; 25 cm

Alternative Title

Molecule surface interactions

Subject

• Gas-solid interfaces
• Surface chemistry
• Molecules > Surfaces
• Molecular dynamics
• Gas-solid interfaces
• Molecular dynamics
• Surface chemistry
• Oberflächenchemie

Note

• "A Wiley-Interscience publication."

Bibliography (note)

• Includes bibliographical references (p. 205-214) and index.

Contents

Simple Adsorption Models -- Lattice Structure and Miller Indices -- Reciprocal Lattice Space -- Lattice Dynamics -- Lattice Dynamics in 3D-Crystals -- Phonons (Normal Mode Solution) -- Atom-Surface Scattering, Kinematics -- Cross Sections -- Surface Diffusion -- Molecular Dynamics Calculations -- Quantum Diffusion -- Interaction Potentials -- Atom-Surface Interaction -- Semi-Empirical Models -- Multisurface Representation -- The BOC-MP or UBI-QEP Methods -- The EDIM Potential -- Density Functional Theory -- Intramolecular Potentials -- Crystal Energies -- Quantum Treatment of Atom/Molecule-Surface Scattering -- Dissipative Quantum Methods -- Simple Models for Atom-Surface Scattering -- Classical Mechanical Treatment -- The Generalized Langevin Equation -- A Model Hamiltonian -- A Semiclassical Approach -- Normal Mode Coordinates -- A Model System -- The Effective Hamiltonian -- Calculation of [Delta]E[subscript int] -- The Debye-Waller Factor -- Electron Gas Theories -- A Free-Electron Gas Treated Within the Hartree and Hartree-Fock Theories -- The Fermi-Thomas Theory -- Density Functional Theory -- Exchange-Correlation Parametrization -- Representations -- The Fast Fourier Transform Method -- Direct Dynamics -- Electron-Hole Pair Excitation -- One-Electron Models -- Second Quantization Approach -- Two-Dimensional Bloch Model -- Density of States -- The R-Matrix Problem -- The Effective Potential -- Phonon and Electron Coupling -- Perspective -- Rate Constants -- Valence Bond Treatment of Four-Electron Systems.

ISBN

• 0471331082
• 9780471331087

LCCN

99038866

OCLC

• ocm41871565
• 41871565
• SCSB-1033820

Owning Institutions

Princeton University Library