Ideas of Quantum Chemistry /
Material type: TextPublication details: Elsevier, 2013ISBN: 9780444594365Online resources: Click here to access onlineItem type | Current library | Call number | Status | Date due | Barcode | Item holds |
---|---|---|---|---|---|---|
e-Books | Central Library, Sikkim University | Not for loan | E-399 |
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
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