Radiative Processes of Two Accelerated Entangled Atoms Near Boundaries

By considering the interaction between a two-atom system and the vacuum massless scalar field in the viewpoint of an instantaneously inertial observer, we study the rates of transition of a uniformly accelerated two-atom system in the symmetric/antisymmetric entangled state near a reflecting boundary and in a cavity, respectively. We find that both the downward transition | ψ ± ⟩ → | g A g B ⟩ and the upward transition | ψ ± ⟩ → | e A e B ⟩ occur for the accelerated two-atom system, as in sharp contrast with the case of a static two-atom system, in which the upward transition can never happen. Similar to the rates of transition of atoms immersed in a thermal bath with the FDU temperature, both the downward transition rate and the upward transition rate are characterized by the Plank factor ( e 2 π ω 0 / a − 1 ) − 1 . This character of the transition rates is very different from the other radiative properties of the accelerated two-atom system, such as the resonance interatomic energy, for which the revisions of the effects of uniform acceleration are never characterized by such a factor. We show with analytical and numerical results that both the downward transition and the upward transition processes can be effectively manipulated by the atomic non-inertial motion and by the presence of boundaries. By comparing the upward transition rate with the downward transition rate, we discover that, when ω 0 ≫ a , with ω 0 and a being the energy space and the proper acceleration of the two-atom system, the disentanglement caused by the upward transition is negligible, while, if ω 0 ≪ a , the disentanglement caused by the upward transition becomes as important as that caused by the downward transition.

Alignment of Buckingham Parameters to Generalized Lennard-Jones Potential Functions

The Lennard-Jones(12-6) and the Exponential-6 potential functions are commonly used in computational softwares for describing the van der Waals interaction energy. Some softwares allow switching between these two potentials under prescribed condition(s) that attempt to connect the parameter relationship between the two functions. Here we propose a technique by which the parameter relationship between both potentials is extracted by simultaneously imposing an equal force constant at the well depth’s minimum and an equal mean interatomic energy from the point of equilibrium to the point of total separation. The former imposition induces good agreement for the interatomic compression and a small change in the interatomic distance near the equilibrium while the latter enables good agreement for large interatomic separation. The excellent agreement exhibited by the plots validates the technique of combined criteria proposed herein

Relationship and discrepancies between the Extended-Rydberg and the Generalized Buckingham potential energy functions

This paper relates the interatomic energy according to the Extended-Rydberg and the Generalized Buckingham potential functions by applying a Maclaurin series expansion on the latter and thereafter comparing it with the former. In so doing, the plotted curves of these two functions not only show equal curvature at the equilibrium state, but also reveal a discrepancy for the finite distortion. It is shown that, when equated at equilibrium, the Generalized Buckingham gives a lower energy in comparison to the Extended-Rydberg at finite bond compression and stretching. However, the energy difference diminishes when the interatomic distance exceeds twice that at equilibrium. Due to such discrepancies upon comparative normalization, it would be beneficial for computational chemists to select the appropriate potential function for the purpose of conservative molecular modeling. .