V Parchaňský, J Kapitán, P Bouř - RSC Advances, 2014 - pubs.rsc.org
Raman optical activity (ROA) is a relatively new method combining the variability of scattering experiments with the structural sensitivity of chiral spectroscopy. Typically, ROA …
Supercapacitors, as promising energy storage devices, have gained significant attention due to their ability to deliver high power and efficient charge storage mechanisms. In this …
Nanoscience is a multidisciplinary skill with elucidated nanoscale particles and their advantages in applications to various fields. Owing to their economical synthesis …
Chiroptical properties and spectroscopies are valuable tools to study chiral molecules and assign absolute configurations. The spectra that result from chiroptical measurements may …
CB Ubah, N Mujafarkani, A Sundaravadivelu… - Journal of Molecular …, 2024 - Elsevier
This work undertakes a comprehensive study encompassing the synthesis, spectral characterization (FT-IR, UV, 1H NMR, 13Csingle bondNMR), exploration of polar solvation …
J Kessler, J Kapitán, P Bouř - The Journal of Physical Chemistry …, 2015 - ACS Publications
Computational methods based on the Schrödinger equation have been traditionally confined to rather small molecules. Using an automatic computational methodology …
P Michal, J Kapitán, J Kessler, P Bouř - Physical Chemistry Chemical …, 2022 - pubs.rsc.org
Vibrational frequencies of modes involving intermolecular motions in liquids are relatively small, in the Raman scattering close to the excitation frequency, and the bands may merge …
Helicenes are known to provide extremely strong optical activity. Prediction of the properties of helicenes may facilitate their design and synthesis for analytical or materials sciences. On …