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Perspectives in electronic structure theory

Bibliographic Details
Main Author: Nalewajski, R. F.
Corporate Author: SpringerLink (Online service)
Format: Online Book
Language:English
Published: Berlin ; New York : Springer, c2012.
Subjects:
Online Access:Online version
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Table of Contents:
  • Pt. 1. Foundations of quantum mechanics
  • pt. 2. Theories of electronic structure
  • pt. 3. Insights from information theory
  • pt. 4. Chemical concepts for molecular structure and reactivity.
  • Part 1. $FOUNDATIONS OF QUANTUM MECHANICS
  • Sources
  • Mathematical Apparatus
  • Basic Concepts and Axioms
  • Hydrogen-Like Atom
  • Part 2.
  • THEORIES OF ELECTRONIC STRUCTURE
  • Approximating Molecular Schrödinger Equation
  • Wave Function Methods
  • Density Functional Theory
  • Part 3.
  • Insights from Information Theory
  • Elements of Information Theory
  • Schrödinger Equations from Information Principles
  • Electron Density as Carrier of Information
  • Bonded Atoms from Information Theory
  • Orbital Communication Theory of the Chemical Bond
  • Part 4.
  • Chemical Concepts for Molecular Structure and Reactivity
  • Alternative Perspectives in Chemical Theories
  • Coupling Between Electronic and Geometrical Structures
  • Qualitative Approaches to Reactivity Phenomena.