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Quantum geometry and adiabaticity in molecules and in condensed matter

2025/03/10 by Raffaele Resta, Resta, Raffaele · 1 citation
Chemistry · Physics and Astronomy · #Advanced Physical and Chemical Molecular Interactions #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci) #Quantum Mechanics and Non-Hermitian Physics #Quantum Physics (quant-ph) #Quantum many-body systems

paper · pdf · doi:10.48550/arxiv.2503.10672

openalex publication_date 2025/03/10 · openalex created_date 2025/10/10 · openalex updated_date 2026/07/28

Abstract

The adiabatic theorem states that when the time evolution of the Hamiltonian is "infinitely slow", a system, when started in the ground state, remains in the instantaneous ground state at all times. This, however, does not mean that the adiabatic evolution of a generic observable obtains simply as its expectation value over the instantaneous eigenstate. As a general principle there is an additional adiabatic term, of quantum-geometrical nature, which is the relevant one for several static or adiabatic observables. This is shown explicitly for the cases of polarizability and infrared tensors (in molecules and condensed matter); rotational g factor and magnetizability (in molecules only). Quantum geometry allows for a transparent derivation and a compact expression for these observables, alternative to the well known sum-over-states Kubo formulas.

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