Classes
- Quantum Theory of MoleculesNBCM039 | Faculty of Mathematics and Physics
- Seminar on Theoretical Chemical PhysicsNBCM046 | Faculty of Mathematics and Physics
- Practical Exercises in Quantum Theory of Molecules INBCM099 | Faculty of Mathematics and Physics
- Practical Exercises in Quantum Theory of Molecules IINBCM116 | Faculty of Mathematics and Physics
- Ab Initio Methods and Density Functional Theory INBCM121 | Faculty of Mathematics and Physics
- Ab Initio Methods and Density Functional Theory IINBCM122 | Faculty of Mathematics and Physics
- Computational Experiments in Molecular Theory IINBCM125 | Faculty of Mathematics and Physics
- Theoretical seminar of biophysics and chemical physicsNBCM180 | Faculty of Mathematics and Physics
- General ChemistryNBCM183 | Faculty of Mathematics and Physics
Publications
- Computational study of short-range interactions in bacteriochlorophyll aggregates2012 | Faculty of Mathematics and Physics
- Study of Electronic Spectra of Free-Base Porphin and Mg-Porphin: Comprehensive Comparison of Variety of Ab Initio, DFT, and Semiempirical Methods2005 | Faculty of Mathematics and Physics, Central Library of Charles University
- Estimation of Electron Spectra Transitions of Free-Based Porphin and Mg-Porphin Using Various Quantum Chemical Approaches2004 | Faculty of Mathematics and Physics, Central Library of Charles University
- Study of Electronic Spectra of Free-Base Porphin and Mg-Porphin:Comprehensive Comparison of Variety of AbInitio, DFT and Semiempirical Methods2004 | Faculty of Mathematics and Physics
- The vertical excitation energies and a lifetime of the two lowest singlet excited states of the conjugated polyenes from C2 to C22: Ab initio, DFT, and semiclassical MNDO-MD simulations2023 | Faculty of Mathematics and Physics
- Vertical Excitation Energies and Lifetimes of the Two Lowest Singlet Excited States of Cytosine, 5-Aza-cytosine, and the Triazine Family: Quantum Mechanics-Molecular Mechanics Studies2023 | Faculty of Mathematics and Physics
- Estimation of electron absorption spectra and lifetime of the two lowest singlet excited states of pyrimidine nucleobases and their derivatives2022 | Faculty of Mathematics and Physics
- A new grand-canonical potential for the thermodynamic description of the reactions in solutions with constant pH2021 | Faculty of Mathematics and Physics, Central Library of Charles University
- QM and QM/MM umbrella sampling MD study of the formation of Hg(II)-thymine bond: Model for evaluation of the reaction energy profiles in solutions with constant pH2020 | Faculty of Mathematics and Physics
- A Dogma in Doubt: Hydrolysis of Equatorial Ligands of Pt-IV Complexes under Physiological Conditions2019 | Faculty of Mathematics and Physics
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