Mathematical physics in theoretical chemistry

✍ Scribed by Blinder S.M., House J.E. (eds.)

• Publisher: Elsevier
• Year: 2019
• Tongue: English
• Leaves: 412
• Series: Developments in physical & theoretical chemistry
• Edition: First edition
• Category: Library

✦ Table of Contents

Content: 1. The Hartree-Fock Approximation 2. Slater and Gaussian Basis Functions and Computation of Molecular Integrals 3. Post Hartree-Fock Methods: Configuration Interaction, Many-Body Perturbation Theory, Couple-Cluster Theory 4. Density-Functional Methods 5. Vibrational Energies and Partition Functions 6. Quantum Monte-Carlo 7. Computational Chemistry on Personal Computers 9. Chemical Applications of Graph Theory 10. Singularity Analysis in Quantum Chemistry 11. Diagrammatic Methods in Quantum Chemistry 12. Quantum Chemistry on a Quantum Computer

✦ Subjects

Chemistry, Physical and theoretical -- Mathematics.;Mathematical physics.