Intermolecular interactions and introduction to statistical thermodynamics 1200-2BLOK4-WYK3
A set of topics for individual parts of the lecture:
1. theoretical description of intermolecular interactions, decomposition of the interaction energy into individual contributions and their interpretation within the perturbation theory, approximate methods of modeling intermolecular interactions;
2. microcanonical and canonical ensemble, partition function (sum-over-states), statistical definition of entropy and temperature, molecular partition functions, reaction equilibrium constants.
Total workload: 30 hours
- class participation: 15 hours
- exam preparation: 10 hours
- exam: 2 hours
- consultations with instructor: 3 hours
Main fields of studies for MISMaP
Course coordinators
Type of course
Mode
Prerequisites (description)
Learning outcomes
The student knows and understands:
K_W01: Has extensive knowledge of the place of chemistry in the system of natural sciences and its importance for the development of humanity.
K_W06: Has the mathematical knowledge necessary to quantitatively describe chemical phenomena and processes specific to a given chemical specialization.
K_W07: Knows, understands, and can explain mathematical description of basic chemical phenomena and processes.
The student is able to:
K_U03: Is able to apply appropriate research methods, techniques, and tools within a given chemical specialization, necessary to explain a given problem.
K_U05: Is able to plan and conduct theoretical research within their chemical specialization.
K_U06: Is able to critically evaluate the results of their own theoretical calculations within their chemical specialization.
Maximum number of absences allowed: 2
Assessment criteria
Written exam. Passing grade is received if student obtains 50% of points.
Practical placement
none
Bibliography
1. Lucjan Piela "Ideas of quantum chemistry”
2. Peter Wiliam Atkins “Physical chemistry”