387x Filetype PPTX File size 1.10 MB Source: staff.ustc.edu.cn
Textbook: Ira N. Levine, Quantum Chemistry, 7th ed. (2014)
References:
a) 严严严严严严严严(I)严严 (2019)
rd
b) David J. Griffith, Introduction to Quantum Mechanics, 3
ed. (2018)
nd
c) R. Shakar, Principles of Quantum Mechanics, 2 ed. (1994)
d) J. J. Sakurai, Modern Quantum Mechanics, (1994)
e) 严严严, 严严严严I/II, 4th ed.
Course Description
To provide a working knowledge of the concepts, basic results and
mathematical skills in quantum mechanics/chemistry
The principles and basic tools in quantum mechanics
Particle-in-box and one-dimensional tunneling problems
Harmonic oscillator
Angular momentum theorem, with applications to molecular
rotation, and electronic orbitals and spins
Hilbert-space formulations and representations
Perturbation theory and variational principle
Introduction of electronic structure theory, with applications to
atomic/molecular structures, spectroscopy, & chemical bonding
Density matrix and Liouville-space descriptions
Quantum entanglement (if possible)
Quantum Mechanics -- Foundation of all modern fields of sci
ences, including chemistry, biology, and material sciences. It is
the ONLY way to TRULY understand
• Nature of atoms, chemical bonds, and molecules
• Structures and properties matters
• Intermolecular forces (hydrogen bonds and van der Waals forces)
• Enzymology, proteinomics, and genomics
• Nanoscience and material science
• Property of electromagnetic radiation (such as light)
• Matter interaction with external electromagnetic fields
Quantum Chemistry is built up on the principles of
quantum mechanics, and provides further the molecular
understanding on the structures and properties of chemical
compounds, materials, and biological processes
Coverage
Topic 0: Opening Remarks and Background Skills
Classical Mechanics; Mathematical Tools in QM
Topic 1: Quantum Mechanics: Concepts and Principles (Ch1)
Birth of QM and landmarks
Topic 2: Solving Schrödiner Equation for Basic Systems (Ch2&4)
Particle in a box; Quantum well; Tunneling; Particle in a ring; Harmonic oscillator
Topic 3: QM Machineries (Ch3-5,7)
QM postulations; Hilbert-space formulations; Representation theory; Commutators vs
uncertainty relations; Harmonic Oscillator via Algebraic Approach; Angular Momentum
Theorem and Applications
Topic 4: Rotation and Vibration Spectroscopy (Ch6)
Topic 5: Electronic Structure and Spectra (Ch6)
Topic 6: Variation Principle and Perturbation Theory (Ch8,9)
Topic 7: Density Matrix & Liouville-space Formulations
Topic 0
A. Background Knowledge
no reviews yet
Please Login to review.