NOTE:

The schedule for the future classes is tentative. Be sure to check this schedule each week for that week's assignment (homework and readings). The assignments currently listed for weeks later in the term are likely to evolve.

The homework problems and the lecture notes (when available) are posted the day of the corresponding class - Click on the HW #.

Legenda:

 

AF = P.W. Atkins, and R.S. Friedman - Molecular Quantum Mechanics, 3rd Edn., Oxford, 1997.
Lev = I.N. Levine - Quantum Chemistry, 5th Edn., Prentice Hall, 1999.
BRR = R.S. Berry, S.A. Rice, and J. Ross - Physical Chemistry, 2nd Edn., Oxford, 2000.

Schedule for Chem 430, Fall 2004
Week Class Date Topic HW/Exams Due Readings   
1 1 Tue Aug 24 Course Intro.
What is Quantum Chemistry?
Origins of QM
Black Body Radiation
HW1
Math dignostic
Tue Aug. 31 AF Ch.0
Lecture notes
Math handout 1
Math handout 2
2 Thu Aug 26 Operators; Commutators
Postulates of QM
    AF 1.0-1.12
Lecture notes
2 3 Tue Aug 31 Postulates of QM
Hermitian operators
HW2
HW1 Solution
Tue Sep 7 AF 1.13-1.23
4 Thu Sep 2 Complementarity
Bracket notation
acceptable psi's
    AF 2.1-2.6
Lecture notes
3 5 Tue Sep 7 Matrix formulation
General Properties, quantization
HW3
HW2 Solution
Tue Sep 14 AF 2.8-2.10
Lecture notes
PRL 1983 paper
6 Thu Sep 9 Free particle, barrier penetration
Tunneling
  AF 2.12-2.18
4 7 Tue Sep 14 harmonic oscillator
(Dirac's operator method)
HW4
HW3 Solution
Tue Sep 21 AF 2.15-2.18
Lecture notes
8 Thu Sep 16 harmonic oscillator (cont'd) Problems for Problem Session
 
Solution to the problems
  AF 2.15-2.18
5 9 Tue Sep 21 Perturbation theory
NO HOMEWORK
 
Please look at last year first midterm exam (download pdf)
Problem session
09/21/04 5pm
Anderson Biology #306
AF 6.1-6.8
10 Thu Sep 23 Perturbation theory
Infinite well with a little "hump": perturbative solution and
exact solution
HW4 Solution   AF 6.1-6.8
6 11 Tue Sep 28 Perturbation theory
Applications
EXAM 1 Tue Oct 5 AF 6.1-6.8
12 Tue Sep 30 Periodic potential
Kronig-Penney Hamiltonian
Energy Bands and Energy Gaps
Perturbative approach: the nearly free electron model
   
7 13 Tue Oct 5 Rotational motion
Particle on a ring
Angular Momentum
Spherical Harmonics
  Thu Oct 14 AF 3.1-3.8
AF Further Info 8-9 (pp 496-498)
Lecture notes
14 Thu Oct 7 Spherical coordinates
Central potential
    AF 4.1-4.7
8 MIDTERM RECESS
15 Thu Oct 14 Angular Momentum
Ladder Operators for the angular momentum
HW5 Thu Oct 21 AF 4.1-4.7
9 16 Tue Oct 19 Angular Momentum
Ladder Operators for the angular momentum
Spin
Coupling of angular momenta
    Supersymmetry and QM
Phys. Rep. 251 (1995) 267-385 (pdf file)
17 Thu Oct 21 Hydrogen atom
Ladder operator for the radial problem
HW6
 
Problem session
10/21/04 5pm
Anderson Biology #306
Thu Oct 28 AF 3.9-3.14
10

18

 

Tue Oct 26

Variation Theorem, Rayleigh-Ritz

We're about 1 lecture behind at this point.

Problem session 10/26/04

SPAC106 5PM

Problems for problem session

 

AF 4.8-4.12

Wigner 3j symbol

Variation Method

Extended Var. Method

19 Thu Oct 28

Variation Theorem, Rayleigh-Ritz

WKB, Rydberg-Klein-Rees

EXAM 2

HWK7

Thu Nov 4

Tue Nov 9

AF 6.9-6.11

WKB notes

RKR notes

11 20 Tue Nov 2

WKB, Rydberg-Klein-Rees

Schedule adjusted to reflect actual lecture topics starting with L20

   

Units & natural constants

The Importance of Being Distinguishable

AF Chapter 7

21 Thu Nov 4

Helium atom, spin

Many-electron atoms

Atomic term symbol

EXAM 2 DUE

 

 

Atomic units

He atom & spin

Many-electron atoms

12 22 Tue Nov 9 Born-Oppenheimer approximation

HW8.pdf

HW8.doc

HW7soln.pdf

HW7soln.doc

 

Tues Nov 16 Born-Oppenheimer
23 Thu Nov 11

Electronic structure of H2+ and H2

     
13 24 Tue Nov 16 Group theory

EXAM 3

HW8 Solution.pdf

J&K Integrals.pdf

HW8 solution.doc

Tue Nov 23 Notes on Group Theory
25 Thu Nov 18 Group theory

 

 

 
14 26 Tue Nov 23 Group theory

EXAM 3 DUE

 
THANKSGIVING RECESS
15 27 Tue Nov 30 Group theory    
28 Thu Dec 2 Group theory

Exam3 solution (pdf)

Exam3 solution.doc

Wed Dec 15 (5pm)