Evolution of Atom-Molecular Eigenstates

Chen, Ju-mei, Li +6 more

Andrea Amadei, Massimiliano Aschi

A theoretical-computational procedure, recently proposed for modelling Vibrational Energy Relaxation (VER) processes of a molecule (Quantum Center, QC) embedded in a complex atomic-molecular system, is extended and applied for analyzing in detail the features of the QC density matrix (DM) temporal evolution. The results, obtained using aqueous azide ion as a case study, show the total lack of coherence in the DM, when the system is prepared to be initially in a pure vibrational eigenstate. This finding is fully in line with the statistical interpretation of the process typically adopted also in the experimental studies where the relaxation processes are all described within the typical schemes of chemical kinetics. Consistently, when the initial vibrational state corresponds to an eigenstate mixture, although initially coherent, the DM relaxes to a fully incoherent condition with a mean lifetime related to the one of the diagonal elements relaxation. These specific DM features turn out to be essentially governed by the thermal equilibrium condition of the atomic-molecular classical coordinates which drive the ensemble of the quantum-trajectories toward the observed statistical regime. Finally, from the analysis of a single long timescale quantum vibrational trajectory it also clearly emerges its ergodic behaviour.

Mario Belloni, Wolfgang Christian

David Guéry-Odelin, A. Ruschhaupt, Anthony Kiely +3 more

Adiabatic evolution along the instantaneous eigenstate of a time-dependent Hamiltonian is used for robust and high fidelity state transfer in atomic and molecular physics. Shortcuts to adiabaticity (STA) are systematic approaches to accomplish the same final state transfer in a faster manner. This article presents an introduction to STA and reviews different theoretical approaches and applications of STA to a range of scientific and engineering tasks in quantum physics and beyond.

Lev Vidmar

Jonathan M. Robbins

Quantum eigenstates undergoing cyclic changes acquire a phase factor of geometric origin. This phase, known as the Berry phase, or the geometric phase, has found applications in a wide range of disciplines throughout physics, including atomic and molecular physics, condensed matter physics, optics, and classical dynamics. In this article, the basic theory of the geometric phase is presented along with a number of representative applications. The article begins with an account of the geometric phase for cyclic adiabatic evolutions. An elementary derivation is given along with a worked example for two-state systems. The implications of time-reversal are explained, as is the fundamental connection between the geometric phase and energy level degeneracies. We also discuss methods of experimental observation. A brief account is given of geometric magnetism; this is a Lorenz-like force of geometric origin which appears in the dynamics of slow systems coupled to fast ones. A number of theoretical developments of the geometric phase are presented. These include an informal discussion of fibre bundles, and generalizations of the geometric phase to degenerate eigenstates (the nonabelian case) and to nonadiabatic evolution. There follows an account of applications. Manifestations in classical physics include the Hannay angle and kinematic geometric phases. Applications in optics concern polarization dynamics, including the theory and observation of Pancharatnam's phase. Applications in molecular physics include the molecular Aharonov-Bohm effect and nuclear magnetic resonance studies. In condensed matter physics, we discuss the role of the geometric phase in the theory of the quantum Hall effect.