3 papers
physics.chem-ph2025
The Effect of Chlorine Substitution on Rotational Speed and Light Absorption of Second Generation Molecular Motors
Ivan Tambovtsev, Ãskar Kristinsson, Hannes Jónsson
The effect of substituting a hydrogen atom by a chlorine atom or a methyl group by a trichloromethyl (CCl3) group at the stereogenic center of light-driven second generation molecu…
physics.chem-ph2025
Fine Tuning of the Rotational Rate of Light-Driven, Second Generation Molecular Motors by Fluorine Substitutions
Ivan Tambovtsev, Yorick L. A. Schmerwitz, Gianluca Levi +4
The relaxation time of several second generation molecular motors is analysed by calculating the minimum energy path between the metastable and stable states and evaluating the tra…
physics.chem-ph2025
Tuning Molecular Motors with Tert-Butyl and Fluorinated Tert-Butyl Groups
Ivan Tambovtsev, Hannes Jónsson
The effect of modifying substituents in the rotor group of five second generation molecular motors is estimated by theoretical calculations. The rotational speed is estimated by ca…