All Stories

  1. Excited state dynamics of a Bodipy derivative with a twisted molecular structure: Combined experimental and theoretical studies
  2. Theoretical investigation on bisarylselanylbenzo-2,1,3-selenadiazoles as potential photosensitizers in photodynamic therapy
  3. Quantum mechanical DFT elucidation of CO2 catalytic conversion mechanisms: Three examples
  4. Food Antioxidants: Chemical Insights at the Molecular Level
  5. The heavy atom effect on Zn(ii) phthalocyanine derivatives: a theoretical exploration of the photophysical properties
  6. Electronic spectra and intersystem spin-orbit coupling in 1,2- and 1,3-squaraines
  7. Ab initio calculations on the1O2quenching mechanism by trans-resveratrol