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Course info
KFCH / C064
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Course description
Department/Unit / Abbreviation
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KFCH
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C064
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Academic Year
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2023/2024
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Academic Year
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2023/2024
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Title
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Formulation of Physico-Chemical Problems
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Form of course completion
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Examination
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Form of course completion
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Examination
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Accredited / Credits
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Yes,
5
Cred.
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Type of completion
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Combined
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Type of completion
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Combined
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Time requirements
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Lecture
2
[HRS/WEEK]
Seminar
3
[HRS/WEEK]
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Course credit prior to examination
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No
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Course credit prior to examination
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No
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Automatic acceptance of credit before examination
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No
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Included in study average
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YES
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Language of instruction
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Czech
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Occ/max
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Automatic acceptance of credit before examination
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No
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Summer semester
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2 / -
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0 / -
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0 / -
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Included in study average
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YES
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Winter semester
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0 / -
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0 / -
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0 / -
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Repeated registration
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NO
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Repeated registration
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NO
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Timetable
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Yes
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Semester taught
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Summer semester
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Semester taught
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Summer semester
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Minimum (B + C) students
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not determined
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Optional course |
Yes
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Optional course
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Yes
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Language of instruction
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Czech
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Internship duration
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0
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No. of hours of on-premise lessons |
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Evaluation scale |
A|B|C|D|E|F |
Periodicity |
každý rok
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Periodicita upřesnění |
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Fundamental theoretical course |
No
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Fundamental course |
No
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Fundamental theoretical course |
No
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Evaluation scale |
A|B|C|D|E|F |
Substituted course
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None
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Preclusive courses
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N/A
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Prerequisite courses
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N/A
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Informally recommended courses
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N/A
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Courses depending on this Course
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N/A
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Histogram of students' grades over the years:
Graphic PNG
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XLS
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Course objectives:
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The goal of the course is to create the complex presumptions for mathematical and physical formulations of routine problems in physical chemistry.
Absolvent of this course is able to construct statistical and mechanistical models and analogies, their description, planning of experiments and data processing, verification and prediction of actions.
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Requirements on student
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Written exam with the possibility of the use of any literature and entering databases. The student solves individually and/or by discussion the given problem from the physical formulation over mathematical model to final processing of results
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Content
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Introduction, evolution trends of calculation methods. Numerical solution of algebraic equations. Numerical solution of system of linear equations. Numerical solution of system of non-linear equations. Interpolation, numerical derivation and integration. Numerical solution of ordinary differential equations. Formulation and modelling of physico-chemical problems, physical reality, simulation. Mathematical description of the models, criteria. Mass and energetic balances. Solving of mathematical models, classification, methods and ways of solving. Analysis of relations between the quantities, linear and multiple linear regression. Non-linear regression, optimization methods, directly seeking and derivative methods. Factor analysis, usage and importasnce, multivariable systém, Placket-Burman method.
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Activities
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Fields of study
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Guarantors and lecturers
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Literature
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-
Basic:
Caldin E. F. Fast Reactions in Solution. Blackwell scientific publications Oxford, 1964.
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Basic:
Formulace a modelování problémů ve fyzikální chemii
(Skopal F.)
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Basic:
Erfurth H., Just G. Modelování a optimalizace chemických procesů. SNTL Praha, 1979.
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Basic:
Skopal F. Skopal F.: Formulace a modelování problémů ve fyzikální chemii. Univerzita Pardubice, 1992.
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Basic:
Wiliam B.I. Statistical Analyzes for Multivariable Systems, Chem. Ing. 29, 69,. 1970.
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Basic:
Ondráček E., Janíček P. Výpočtové modely v technické praxi. SNTL Praha, 1990.
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Basic:
Černá, R., Machalický, M., Vogel, J., Zlatník, C. Základy numerické matematiky a programování. SNTL Praha, 1987.
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Prerequisites - other information about course preconditions |
Good knowldege of mathematics, physics and physical chemistry, creative ability in the description of the reality |
Competences acquired |
Checks of the study have written form with the possibility of use of arbitrary literature and databasies. The student solves the given problem separately and/or with discussion as from the physical formulation over a mathematical model up to the final processing of results. |
Teaching methods |
- Work with text (with textbook, with book)
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Assessment methods |
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