2 papers
physics.chem-ph2023
Spin-vibronic dynamics in open-shell systems beyond the spin Hamiltonian formalism
Lorenzo A. Mariano, Sourav Mondal, Alessandro Lunghi
Vibronic coupling has a dramatic influence over a large number of molecular processes, ranging from photo-chemistry, to spin relaxation and electronic transport. The simulation of…
cond-mat.mtrl-sci2022
Unravelling the contributions to spin-lattice relaxation in Kramers single-molecule magnets
Sourav Mondal, Alessandro Lunghi
The study of how spin interacts with lattice vibrations and relaxes to equilibrium provides unique insights on its chemical environment and the relation between electronic structur…