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We present a time-reversible Born-Oppenheimer molecular dynamics scheme, based on self-consistent Hartree-Fock or density functional theory, where both the nuclear and the electronic degrees of freedom are propagated in time. We show how a…

Materials Science · Physics 2009-11-11 Anders M. N. Niklasson , C. J. Tymczak , Matt Challacombe

We present a new quantum adiabatic theorem that allows one to rigorously bound the adiabatic timescale for a variety of systems, including those described by unbounded Hamiltonians. Our bound is geared towards the qubit approximation of…

Quantum Physics · Physics 2024-01-17 Evgeny Mozgunov , Daniel A. Lidar

The method of adiabatic invariants for time dependent Hamiltonians is applied to a massive scalar field in a de Sitter space-time. The scalar field ground state, its Fock space and coherent states are constructed and related to the particle…

General Relativity and Quantum Cosmology · Physics 2008-11-26 C. Bertoni , F. Finelli , G. Venturi

We look at the time dependent fluctuations of the electrical charge in an open 1D quantum system represented by a quantum dot experiencing random lateral motion. In essentially non-adiabatic settings we study both diffusive and ballistic…

Chaotic Dynamics · Physics 2016-04-19 Stanislav Derevyanko , Daniel Waltner

Suppressing undesired nonunitary effects is a major challenge in quantum computation and quantum control. In this work, by considering the adiabatic dynamics in presence of a surrounding environment, we theoretically and experimentally…

We study the Landau-Zener Problem for a decaying two-level-system described by a non-hermitean Hamiltonian, depending analytically on time. Use of a super-adiabatic basis allows to calculate the non-adiabatic transition probability P in the…

Quantum Physics · Physics 2009-11-13 R. Schilling , Mark Vogelsberger , D. A. Garanin

We propose a description of nonequilibrium systems via a simple protocol that combines exchange-correlation potentials from density functional theory with self-energies of many-body perturbation theory. The approach, aimed to avoid double…

Strongly Correlated Electrons · Physics 2016-06-15 M. Hopjan , D. Karlsson , S. Ydman , C. Verdozzi , C. -O. Almbladh

Resonances which result from perturbation of embedded eigenvalues are studied by time dependent methods. A general theory is developed, with new and weaker conditions, allowing for perturbations of threshold eigenvalues and relaxed Fermi…

Mathematical Physics · Physics 2009-10-31 O. Costin , A. Soffer

Recent experiments with increasingly larger numbers of qubits have sparked renewed interest in adiabatic quantum computation, and in particular quantum annealing. A central question that is repeatedly asked is whether quantum features of…

Quantum Physics · Physics 2015-06-22 Tameem Albash , Daniel A. Lidar

We discuss the application of the adiabatic perturbation theory to analyze the dynamics in various systems in the limit of slow parametric changes of the Hamiltonian. We first consider a two-level system and give an elementary derivation of…

Statistical Mechanics · Physics 2015-05-14 C. De Grandi , A. Polkovnikov

We study approximate solutions to the Schr\"odinger equation $i\epsi\partial\psi_t(x)/\partial t = H(x,-i\epsi\nabla_x) \psi_t(x)$ with the Hamiltonian given as the Weyl quantization of the symbol $H(q,p)$ taking values in the space of…

Mathematical Physics · Physics 2007-05-23 Gianluca Panati , Herbert Spohn , Stefan Teufel

Ehrenfest, Born-Oppenheimer, Langevin and Smoluchowski dynamics are shown to be accurate approximations of time-independent Schr\"odinger observables for a molecular system avoiding caustics, in the limit of large ratio of nuclei and…

Mathematical Physics · Physics 2010-01-12 Anders Szepessy

We derive an adiabatic theory for a stochastic differential equation, $ \varepsilon\, \mathrm{d} X(s) = L_1(s) X(s)\, \mathrm{d} s + \sqrt{\varepsilon} L_2(s) X(s) \, \mathrm{d} B_s, $ under a condition that instantaneous stationary states…

Mathematical Physics · Physics 2014-09-05 Martin Fraas

The adiabatic theorem is a fundamental result established in the early days of quantum mechanics, which states that a system can be kept arbitrarily close to the instantaneous ground state of its Hamiltonian if the latter varies in time…

Quantum Gases · Physics 2022-06-01 Oleg Lychkovskiy , Oleksandr Gamayun , Vadim Cheianov

We present and discuss a general density-matrix description of energy-dissipation and decoherence phenomena in open quantum systems, able to overcome the intrinsic limitations of the conventional Markov approximation. In particular, the…

Quantum Physics · Physics 2015-05-30 Michele Pepe , David Taj , Rita Claudia Iotti , Fausto Rossi

We study a one-dimensional non-stationary Schr\"odinger equation with a potential slowly depending on time. The corresponding stationary operator depends on time as on a parameter. It has a finite number of negative eigenvalues and…

Mathematical Physics · Physics 2016-09-30 Alexander Fedotov

Fermi energies in fullerene compounds and cuprates are extremely small as consequence of the small number of charge carriers and are comparable to the phonon frequency scale. In this situation the conventional Migdal-Eliashberg theory does…

Superconductivity · Physics 2009-10-31 M. Botti , E. Cappelluti , C. Grimaldi , L. Pietronero

We propose a new dynamical method to connect equilibrium quantum phase transitions and quantum coherence using out-of-time-order correlations (OTOCs). Adopting the iconic Lipkin-Meshkov-Glick and transverse-field Ising models as…

Quantum Physics · Physics 2020-12-21 Robert J. Lewis-Swan , Sean R. Muleady , Ana Maria Rey

Motivated by a recent proposal on the possibility of observing a monopole in the band structure, and by an increasing interest on the role of Berry phase in spintronics, we studied the adiabatic motion of a wave packet of Bloch functions,…

Mesoscale and Nanoscale Physics · Physics 2010-04-05 Ryuichi Shindou , Ken-Ichiro Imura

Adiabatic passage employs a slowly varying time-dependent Hamiltonian to control the evolution of a quantum system along the Hamiltonian eigenstates. For processes of finite duration, the exact time evolving state may deviate from the…

Quantum Physics · Physics 2021-06-18 Albert Benseny , Klaus Mølmer