Quantum Theory of Polymers

Proceedings of the NATO Advanced Study Institute on Electronic Structure and Properties of Polymers held at Namur, Belgium, 31 August–14 September, 1977

Editors:

ISBN: 978-94-009-9814-8 (Print) 978-94-009-9812-4 (Online)

Table of contents (17 chapters)

  1. Front Matter

    Pages i-xi

  2. No Access

    Book Chapter

    Pages 1-22

    LCAO Methods for Band Structure Calculations of Polymers

  3. No Access

    Book Chapter

    Pages 23-30

    The Evaluation of Electron Repulsion Integrals

  4. No Access

    Book Chapter

    Pages 31-48

    X-Ray Photoelectron Spectroscopy and its Application to Polymer Electronic Structure Studies

  5. No Access

    Book Chapter

    Pages 49-73

    Correlation Energy in Solids

  6. No Access

    Book Chapter

    Pages 75-101

    Quantum Mechanical Treatment of Excited Electronic States of Polymers

  7. No Access

    Book Chapter

    Pages 103-116

    Coupled Cluster many Electron Theory and the Cohesive Energy of Large Systems Consisting of Weakly Interacting Subsystems

  8. No Access

    Book Chapter

    Pages 117-135

    Fourier Representation Methods in Electronic Structure Studies of Crystals and Polymers

  9. No Access

    Book Chapter

    Pages 137-167

    Linked-Cluster Perturbation Theory for Closed and Open-Shell Systems: Derivation of Effective π-Electron Hamiltonians

  10. No Access

    Book Chapter

    Pages 169-184

    Methods for the Treatment of Disordered Systems with Possible Applications to Aperiodic Polymers

  11. No Access

    Book Chapter

    Pages 185-198

    Electron States of Structurally-Disordered Chains

  12. No Access

    Book Chapter

    Pages 199-227

    Theoretical Models of Chemisorption of Ions and Small Molecules on Polymers

  13. No Access

    Book Chapter

    Pages 229-255

    Hydrogen Bonding between Molecules or Ions and in Molecular Crystals

  14. No Access

    Book Chapter

    Pages 257-278

    Electronic Structure of Biopolymers

  15. No Access

    Book Chapter

    Pages 279-288

    Energy Band Structure of Highly Conducting Polymers

  16. No Access

    Book Chapter

    Pages 289-312

    Quantum Mechanical Treatment of Transport Properties of Semiconductors: Possible Application to Polymers

  17. No Access

    Book Chapter

    Pages 313-333

    Quantum Theoretical Treatment of Electronic Effects on the Mechanical Properties of Semiconductors: Possible Application to Polymers

  18. No Access

    Book Chapter

    Pages 335-366

    Theoretical Investigation of the Transport Properties of Polymers and Organic Molecular Crystals

  19. Back Matter

    Pages 367-376