Current projects
- Simulating the infrared spectra of small protonated water clusters. here
- A ‘clusters-in-liquid’ method for calculating infrared
spectra identifies the proton-transfer mode in acidic
aqueous
solutions. here
Some past projects
- Intraband relaxation of Frenkel excitons in
sexithiophene
crystals. here
- Vibronic contributions to the spectral shape of
intense exciton absorption in oligothiophene
crystals. here
- Wysokoenergetyczne stany z przeniesieniem
ladunku w krysztale
kwatertiofenu. here
- Unbound exciton-phonon states in oligothiophene
crystals.
here
- Sodium atom in water clusters - theoretical
study.
here
and
here
-
niedoida - general-propose quantum-chemical
package.
- Theoretical interpretation of the
electroabsorption spectrum of the
2,2':5',2'':5'',2'''-quaterthiophene.
here
- sauron - computational cluster for student's
research
