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Proseminar of Quantum Chemistry - NBCM351

Title:	Proseminář kvantové chemie
Guaranteed by:	Institute of Physics of Charles University (32-FUUK)
Faculty:	Faculty of Mathematics and Physics
Actual:	from 2020
Semester:	both
E-Credits:	4
Hours per week, examination:	1/2, C [HT]
Capacity:	unlimited
Min. number of students:	unlimited
4EU+:	no
Virtual mobility / capacity:	no
State of the course:	taught
Language:	Czech
Teaching methods:	full-time
Teaching methods:	full-time
Note:	you can enroll for the course in winter and in summer semester

Guarantor:	RNDr. Václav Profant, Ph.D.
Pre-requisite :	NOFY127

Opinion survey results Examination dates WS schedule SS schedule Noticeboard

Annotation -

Last update: prof. RNDr. Marek Procházka, Ph.D. (14.05.2020)

The seminar is intended for practical acquaintance with the basics of quantum chemical calculations. Suitable for students bachelor's and subsequent master's studies with knowledge at the level of the course Introduction to Quantum Mechanics (NOFY027). Particularly suitable as a supplement to the lecture Quantum Theory of Molecules (NBCM039).

Aim of the course - Czech

Last update: prof. RNDr. Marek Procházka, Ph.D. (30.04.2020)

Získání základního přehledu v oblasti kvantové výpočetní chemie. Praktické seznámení s výpočty molekulových vlastností prostřednictvím dostupných programů.

Course completion requirements -

Last update: RNDr. Václav Profant, Ph.D. (23.09.2021)

Credit. The condition for obtaining the credit is 70% participation and elaboration of the credit project.

Teaching methods - Czech

Last update: prof. RNDr. Marek Procházka, Ph.D. (30.04.2020)

Seminář. Praktická cvičení.

Syllabus -

Last update: prof. RNDr. Marek Procházka, Ph.D. (14.05.2020)

Description of the structure of molecules (Z-matrix), Principles of quantum chemical calculations, Areas of potential energy, Calculations of properties of atoms and molecules.