Ideas of Quantum Chemistry /

Chapter 1 - The Magic of Quantum Mechanics

Chapter 2 - Schrödinger Equation

Chapter 3 - Beyond the Schrödinger Equation

Chapter 4 - Exact Solutions–Our Beacons

Chapter 5 - Two Fundamental Approximate Methods

Chapter 6 - Separation of Electronic and Nuclear Motions

Chapter 7 - Motion of Nuclei

Chapter 8 - Orbital Model of Electronic Motion in Atoms and Molecules

Chapter 9 - Orbital Model of Electronic Motion in Periodic Systems

Chapter 10 - Correlation of the Electronic Motions

Chapter 11 - Chasing Correlation Dragon: Density Functional Theory (DFT)

Chapter 12 - The Molecule Subject to the Electric or Magnetic Field

Chapter 13 - Intermolecular Interactions

Chapter 14 - Chemical Reactions

Chapter 15 - Information Processing–The Mission of Chemistry



Appendix A - Reminding Matrices and Determinants

Appendix B - A Few Words on Spaces, Vectors, and Functions

Appendix C - Group Theory in Spectroscopy

Appendix D - A Two-State Model

Appendix E - Dirac Delta Function

Appendix F - Translation versus Momentum and Rotation versus Angular Momentum

Appendix G - Vector and Scalar Potentials

Appendix H - Optimal Wave Function for the Hydrogen-Like Atom

Appendix I - Space- and Body-Fixed Coordinate Systems

Appendix J - Orthogonalization

Appendix K - Diagonalization of a Matrix

Appendix L - Secular Equation ( )

Appendix N - Lagrange Multipliers Method

Appendix O - Penalty Function Method

Appendix P - Molecular Integrals with Gaussian Type Orbitals 1s

Appendix Q - Singlet and Triplet States for Two Electrons

Appendix R - The Hydrogen Molecular Ion in the Simplest Atomic Basis Set

Appendix S - Population Analysis

Appendix T - Dipole Moment of a Lone Pair

Appendix U - Second Quantization

Appendix V - Hydrogen Atom in Electric Field–The Variational Approach

Appendix W - NMR Shielding and Coupling Constants–Derivation

Appendix X - Multipole Expansion

Appendix Y - Pauli Deformation

Appendix Z - Acceptor-Donor Structure Contributions in the MO Configuration