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
Type of course
Mode
Prerequisites (description)
Course coordinators
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”
Additional information
Additional information (registration calendar, class conductors, localization and schedules of classes), might be available in the USOSweb system: