Development and applications of the methods for the study of the systems with unusual electron structure.Supervisor: prof. Ing. Stanislav Biskupič, DrSc.
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|Project description:||Quantum-chemical study of push-pull olefins, phosphazenes, transition metal complexes and similar compounds with unusual electron structure. Experimental and theoretical vibration analysis of some organic systems. Development and interpretation of the methods for the simulation of diffusion and viscosity coefficients. Study of energy characteristics of van der Waals complexes. Development and interpretation of methods for "experimental wave function" extraction from X-ray diffraction data.|
|Kind of project:||VEGA ()|
|Department:||Department of Physical Chemistry (IPC FCFT)|
|Project status:||Successfully completed|
|Project start date :||01. 01. 2009|
|Project close date:||31. 12. 2011|
|Number of workers in the project:||2|
|Number of official workers in the project:||0|