Abstract
Coupled hindered rotor model is crucial for exploring the rotational dynamics of complex molecules under different external environments. When coupled hindered rotor molecules are subjected to the combined action of static electric and laser fields, their rotational dynamics get significantly modified, leading to interesting physics. In this study, we solve the time-independent Schrödinger equation for the coupled pair of rotors in the combined action of static electric and laser fields using the nine-point finite difference method and obtain rotational energy spectra and eigenvectors. We then use the partition function approach to understand thermal behaviour by studying thermal properties like heat capacity and entropy. We also explore the impact of temperature, coupling strength, and external fields strength parameters on these properties. The orientation of the coupled rotor is strongly dependent on the coupling strength between the coupled rotors as well as the hindrance. We analyse this directional parameter under a broad range of barrier height, coupling strength, and external fields strength parameters. Our analysis may provide insight into the rich and interesting physics, which may pave the way for future experimental and theoretical studies in this area.
Published Version
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a call