CHEMY302-19A (HAM)

Advanced Physical Chemistry

15 Points

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Division of Health Engineering Computing & Science
School of Science

Staff

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Convenor(s)

Marcus Wilson

Marcus Wilson
4834
EF.3.04
Arranging an appointment via email is best, but you can try my office anytime the door is open.
marcus.wilson@waikato.ac.nz

Lecturer(s)

Joseph Lane

Joseph Lane
9391
E.3.07
Students are welcome to drop by my office anytime
joseph.lane@waikato.ac.nz

Michael Mucalo

Michael Mucalo
4404
F.G.06C
Please email ahead of the meeting, thanks!
michael.mucalo@waikato.ac.nz

Administrator(s)

Placement Coordinator(s)

Tutor(s)

Student Representative(s)

Lab Technician(s)

Librarian(s)

: cheryl.ward@waikato.ac.nz

You can contact staff by:

  • Calling +64 7 838 4466 select option 1, then enter the extension.
  • Extensions starting with 4, 5, 9 or 3 can also be direct dialled:
    • For extensions starting with 4: dial +64 7 838 extension.
    • For extensions starting with 5: dial +64 7 858 extension.
    • For extensions starting with 9: dial +64 7 837 extension.
    • For extensions starting with 3: dial +64 7 2620 + the last 3 digits of the extension e.g. 3123 = +64 7 262 0123.
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Paper Description

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This paper explores theory and practical techniques in physical chemistry. We shall look at quantum mechanics and how it informs spectroscopic methods; we will use rotation spectra for finding physical properties of molecules. We will consider theory and application of statistical thermodynamics including surface chemistry effects such as adsorption and surface tension. We also will demonstrates how computational chemistry can be used to predict reaction thermodynamics and kinetics.
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Paper Structure

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This paper includes three lectures a week and three-hour laboratory sessions. The labs are in the second half of the semester. In addition, there are two tests and two assignments.
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Learning Outcomes

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Students who successfully complete the course should be able to:

  • Apply quantum mechanical concepts such as the uncertainty principle and de Broglie wavelength to describe small objects
    Linked to the following assessments:
  • Write down Schrodinger's equation and use it to describe a particle in a one-dimensional box; apply this understanding to real quantum systems
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  • Describe the quantized electronic, vibrational and rotational states of molecules and explain how these relate to vibration and rotation spectra
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  • Determine bond length from a rotational spectrum
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  • Use selection rules for quantum transitions to interpret absorption spectra
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  • Calculate how isotopic substitution will change vibration and rotation spectra
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  • Calculate the population of particles at a given energy using the Boltzmann distribution and describe a canonical ensemble
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  • Describe the behaviour of photovoltaic materials in terms of electronic transitions
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  • Find the electronic, vibrational, rotational and translational partition functions for a molecule.
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  • Calculate the internal energy, enthalpy, entropy and Gibbs free energy of a molecule using statistical thermodynamics
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  • Use computational chemistry to investigate the potential energy surface of a simple molecule and to predict reaction spontaneity
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  • Describe measurement of adsorption as well as instrumental techniques for measuring surface tension with a focus on the Du Nouy methods
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  • Determine interface type, describe surface tension, activity, chemical potential and the Gibbs adsorption isotherm
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  • Describe characteristics of solid surfaces, models of adsorption behaviour such as Langmuir, BET and applications of BET measurements
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  • Describe the enthalpy of adsorption and other thermodynamic parameters, as well as the Van’t Hoff equation, surface reactions and catalysis
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  • Describe the preparation and properties of colloids and micelles, and discuss their technological importance in today’s world
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  • Make measurements of physical chemistry systems in a laboratory, and record and interpret the results
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  • Write clear, concise laboratory reports with coherent discussion; use appropriate language, formatting and referencing
    Linked to the following assessments:
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Assessment

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Assessment Components

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The internal assessment/exam ratio (as stated in the University Calendar) is 50:50. There is no final exam. The final exam makes up 50% of the overall mark.

The internal assessment/exam ratio (as stated in the University Calendar) is 50:50 or 0:0, whichever is more favourable for the student. The final exam makes up either 50% or 0% of the overall mark.

Component DescriptionDue Date TimePercentage of overall markSubmission MethodCompulsory
1. Exam
50
✔
2. Laboratories (all 4 writeups)
7 Jun 2019
4:30 PM
30
  • Hand-in: Faculty Information (FG Link)
3. Test 1
4 Apr 2019
12:00 PM
5
  • Hand-in: In Lecture
4. Test 2
30 May 2019
12:00 PM
5
  • Hand-in: In Lecture
5. Assignment 1
15 Mar 2019
4:30 PM
5
  • Hand-in: Faculty Information (FG Link)
6. Assignment 2
7 Jun 2019
4:30 PM
5
  • Hand-in: Faculty Information (FG Link)
Assessment Total:     100    
Failing to complete a compulsory assessment component of a paper will result in an IC grade
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Required and Recommended Readings

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Recommended Readings

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Atkins, A., de Paula, J. & Keeler, J. (2018) Atkins' Physical Chemistry. 11th edition, Oxford University Press.

Engel, T. & Reid, P. (2014) Physical Chemistry. 3rd edition, Pearson.

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Online Support

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This paper has a Moodle page (http://elearn.waikato.ac.nz) where you will be able to access the laboratory manaul. There are also discussion forums where you can both ask and answer questions.

PLEASE NOTE: Moodle will be used for class notices etc and it is your responsibility to regularly check the site and your appropriate e-mail account. Instructions provided on Moodle and during lectures are considered to be given to the class as a whole.

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Workload

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Lectures: 36 hours

Labs: preparation, attending and write-up: 30 hours

Preparation for tests and exams: 30 hours

Assignments: 10 hours

Private study: 44 hours

Total: 150 hours

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Linkages to Other Papers

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Prerequisite(s)

Prerequisite papers: CHEMY202 or CHEM212 and CHEM214

Corequisite(s)

Equivalent(s)

Restriction(s)

Restricted papers: CHEM312, CHEM314, CHEM302

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