Amita Dua, Chayannika Singh

Quantum Chemistry

Classical to Computational

• Gebundenes Buch

Produktbeschreibung

This book discusses major developments of quantum mechanics from classical to computational chemistry. It is student and user friendly and includes exhaustive derivations, mathematical proofs, and theorems.

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Produktdetails

• Verlag: Taylor & Francis Ltd
• Seitenzahl: 621
• Erscheinungstermin: 2. August 2024
• Englisch
• Abmessung: 234mm x 156mm
• Gewicht: 1330g
• ISBN-13: 9781032789897
• ISBN-10: 1032789891
• Artikelnr.: 70147425

Autorenporträt

Amita Dua, Assistant Professor, Department of Chemistry, Dyal Singh College, University of Delhi, Delhi, India Chayannika Singh, Assistant Professor, Department of Chemistry, Deen Dayal Upadhyaya College, University of Delhi, Delhi, India

Inhaltsangabe

1. Classical Mechanics
2. Towards Quantum Mechanics
3. Introduction to Quantum Mechanics
4. Particle in a Box: Quantisation of Translational Energy
5. Rigid Rotator: Quantisation of Rotational Energy
6. Linear Harmonic Oscillator: Quantisation of Vibrational Energy
7. "Hydrogen Atom": Quantisation of Electronic Energy
8. Multielectron System and Approximate Methods
9. Chemical Bonding
10. Hückel Molecular Orbital Theory
11. Basics of Computational Chemistry
Appendices
Index