Advances in the Theory of Atomic and Molecular Systems

Dynamics, Spectroscopy, Clusters, and Nanostructures

ISBN: 978-90-481-2984-3 (Print) 978-90-481-2985-0 (Online)

Table of contents (13 chapters)

  1. Front Matter

    Pages I-XII

  2. Quantum Dynamics and Spectroscopy

    1. Front Matter

      Pages 1-1

    2. No Access

      Book Chapter

      Pages 3-34

      Quantum Theory in Terms of Cumulant Variables

    3. No Access

      Book Chapter

      Pages 35-45

      Nonclassical Phase Space Jumps and Optimal Spawning

    4. No Access

      Book Chapter

      Pages 47-66

      On the Differential Cross Sections in Complex-Forming Atom–Diatom Reactive Collisions

    5. No Access

      Book Chapter

      Pages 67-80

      Shared Memory Parallelization of the Multiconfiguration Time-Dependent Hartree Method and Application to the Dynamics and Spectroscopy of the Protonated Water Dimer

    6. No Access

      Book Chapter

      Pages 81-101

      Structural Properties and Torsional Dynamics of Peroxides and Persulfides

    7. No Access

      Book Chapter

      Pages 103-124

      Theoretical Spectroscopy of Inner-Shell Electronic Processes and Photochemistry of Fluorescent Molecules

    8. No Access

      Book Chapter

      Pages 125-152

      Electron-β-Nuclear Spectroscopy of Atoms and Molecules and Chemical Bond Effect on the β-Decay Parameters

  3. Complexes and Clusters

    1. Front Matter

      Pages 153-153

    2. No Access

      Book Chapter

      Pages 155-181

      Quantum Chemical Approach to Interatomic Decay Rates in Clusters

    3. No Access

      Book Chapter

      Pages 183-200

      Spectroscopy of Atoms in Liquid Helium Environment: A Theoretical Perspective

    4. No Access

      Book Chapter

      Pages 201-215

      Level-Structure and Magnetic Properties from One-Electron Atoms to Clusters with Delocalized Electronic Orbitals: Shell Models for Alkali Trimers

  4. Nanostructures and Complex Systems

    1. Front Matter

      Pages 217-217

    2. No Access

      Book Chapter

      Pages 219-251

      Influence of the Level of Protonation on the Geometry and the Electronic Structure of Emeraldine Oligomers

    3. No Access

      Book Chapter

      Pages 253-264

      Quantum Mechanical Examination of Optical Absorption Spectra of Silver Nanorod Dimers

    4. No Access

      Book Chapter

      Pages 265-277

      On the Electronic Spectra of a Molecular Bridge Under Non-Equilibrium Electric Potential Conditions

  5. Back Matter

    Pages 279-288