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Physical Chemistry I

Type of study Bachelor
Language of instruction Czech
Code 651-2011/01
Abbreviation FCHI
Course title Physical Chemistry I
Credits 5
Coordinating department Department of Chemistry and Physico-Chemical Processes
Course coordinator doc. Ing. Lenka Řeháčková, Ph.D.

Subject syllabus

- Gaseous state - general characteristics. Description of thermodynamics state of ideal and real gases using equations of state. Condensation of gases - definition, conditions, critical point, practical application of gas condensation. Joule-Thomson effect, Joule-Thomson coefficient and its dependence on temperature, inverse temperature, practical use.
- Definition of selected thermodynamic terms. Formulation and analysis of the first law of thermodynamics, its consequences, internal energy, enthalpy. Heat capacities - definitions, types, mutual differences, changes with temperature and during a chemical reaction. Pressure–volume work of ideal and real gas in isochoric, isobaric, isothermal and adiabatic processes.
- Thermodynamic definitions of molar heats, heating and cooling of substances including isothermal phase transformations. Thermochemistry - definitions of selected terms, thermochemical laws (Lavoisier and Laplace's law, Hess' law) and their practical use. Calculation of heat of reaction and its dependence on temperature - Kirchhoff's equations, practical applications. Calculation of maximum adiabatic temperature, enthalpy balance in dependence on a change of reaction conditions, practical use.
- Formulation and analysis of the second law of thermodynamics and its consequences. Thermal machines, Carnot heat engine, thermodynamic efficiency, Carnot cycle. General characteristics of equilibrium states - definition, types, description using appropriately chosen quantities. Entropy, its interpretation and dependence on thermodynamic state variables (adiabatic and isothermal process, entropy change with temperature, pressure and volume, during chemical reaction including isothermal phase transformations).
- Thermodynamic potentials - Gibbs, Helmholtz energy, relations between thermodynamic quantities. Dependence of Gibbs and Helmholtz energy on temperature – the Gibbs-Helmholtz equation, derivation, analysis, meaning, conditions of thermodynamic equilibrium. Maxwell's relations. Partial molar quantities, chemical potential, activity.
- Chemical equilibria, conditions for chemical equilibrium, physicochemical description of equilibrium states. Equilibrium constants - definition, types, meaning, use, their mutual conversion. Equations of reaction isotherm, application of equations to individual systems. Degree of dissociation.
- Factors that affect chemical equilibrium - the influence of temperature (equation of reaction isobar and isochore), pressure, inert component and concentration of reactants.
- Phase equilibria and their description. Gibbs phase rule, the phase diagram of a one-component system, Clapeyron and Clausius - Clapeyron equations.
- Phase equilibria in multicomponent systems. Solutions and their classification. Definition of solution composition, description of solutions using empirical laws, Raoult's and Henry's law.
- Real solutions, definition of component activity in terms of various standard states. Multicomponent systems, interaction coefficients in multicomponent systems. Thermodynamic functions of solutions, differential and integral thermodynamic quantities.
- Thermodynamic models of ideal, real, regular and athermal solutions. Gibbs - Duhem equation. Dependence of activity and activity coefficient on temperature. Colligative properties of solutions and their characterization, lowering of solvent vapor pressure above solution of non-volatile substance, ebullioscopic and cryoscopic effect, osmotic pressure.
- Phase diagrams of binary liquid systems – different miscibility of components, general characteristics of phase diagrams, phase diagrams of totally miscible liquids. Distillation - simple distillation, rectification, isothermal and isobaric distillation, practical use.
- Phase diagrams of partially miscible liquids, phase diagrams in binary systems with immiscible liquids, ternary systems (characterization). Distribution equilibria, material balance, the importance of extraction and its application. Phase diagrams for three-component systems. Basic properties of ternary phase diagrams for liquid systems.

The content of theoretical exercises will be in accordance with the syllabus.
A Lab exercise:
1. Laboratory task: Phase diagram of a three-component system
2. Laboratory task: Determination of partial molar volumes in binary liquid solutions
3. Laboratory task: Thermal decomposition of calcium carbonate
4. Laboratory task: Degree of association and equilibrium constant of electrolytic dissociation of benzoic acid


Literature

[1] Levine, I., Physical chemistry 6th Edition, McGraw-Hill, New York, 2008

Advised literature

[1] Levenspiel, O., Chemical Reaction Engineering 3rd Edition, John Wiley & Sons, USA, 1999