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Theoretical Chemistry

Ab initio Quantum Chemistry
- Study of the molecular and electronic structure of small molecules via ab initio quantum chemical calculations.
Ab initio computing facilities
Molecular Dynamics Simulations
- Study of the intermolecular forces in liquids in normal and supercritical phases.
- Study of the properties of non-equilibrium systems.
Molecular dynamics simulations group
 
Ab initio Quantum Chemistry
- High accuracy quantum chemical calculations.
Ab initio computing facilities
Statistical Thermodynamics far from equilibrium
- Ion transport in electrostatic field studied via kinetic theory and computer simulations.
Molecular dynamics simulations group
 

Thermodynamic Properties

Electrolytes and Solvents
- Study of the thermodynamic properties (viscosity, conductivity, etc.) of liquid mixtures.
Solution Thermodynamics
Macromolecules
- Study of the thermal and thermodynamic properties (viscosity, surface tension, etc.) of macromolecular solutions and biomolecules.
Solids
- Study of the thermodynamic properties of molten solids and polymers.
Scanning calorimeter
 

Spectroscopy

Dielectric Spectroscopy
- Electric properties and structure of solids as a function of temperature.
Dielectric spectroscopy
Raman Spectroscopy
- Temperature dependent studies of molecular conformations
FT Raman
 
Surface Science

Nuclear Chemistry

- Adsorption/desorption of gases at low temperatures
Surface Chemistry
- Analysis of nuclear reaction data.
- Observation and analysis of elementary radioactive processes.

Radiochemistry Laboratory
 
Facilities
- Walk-in cooler
Cooler
 
Cooler inside
- Machine shop
Machine Shop
 
Machine Shop
 
A complete list of master's and Ph. D. theses titles awarded through the Laboratory of Physical Chemistry as well as a complete list of research articles published during the period 1996 - 2000 is available. The corresponding lists of theses and publications in pdf and html formats for the period 2001-2005 are also available. All theses and papers publisched in the years 2006-2010 can be found here.