Related papers: How to correct Ehrenfest nonadiabatic dynamics in …
Nonadiabatic geometric quantum computation (NGQC) and nonadiabatic holonomic quantum computation (NHQC) have been proposed to reduce the run time of geometric quantum gates. However, in terms of robustness against experimental control…
A semiclassical theory is developed for the appearance of an excitation gap in a ballistic chaotic cavity connected by a point contact to a superconductor. Diffraction at the point contact is a singular perturbation in the limit $\hbar\to…
We present a detailed derivation and numerical tests of a new mixed quantum-classical scheme to deal with non-adiabatic processes. The method is presented as the zero-th order approximation to the exact coupled dynamics of electrons and…
Two classical stochastic processes are considered, the Ehrenfest process, introduced in 1907 in the kinetic theory of gases to describe the heat exchange between two bodies and the Engset process, one of the early (1918) stochastic models…
In this thesis, it is presented a set of results in adiabatic dynamics (closed and open system) and transitionless quantum driving that promote some advances in our understanding on quantum control and Hamiltonian inverse engineering. In…
Relations similar to work and exchange fluctuations have been recently derived for open systems dynamically evolving in the presence of an ancilla. Extending these relations and constructing a non-equilibrium Helmholtz equation we derive a…
A new methodology of simulating nonadiabatic dynamics using frozen-width Gaussian wavepackets within the moving crude adiabatic representation with the on-the-fly evaluation of electronic structure is presented. The main feature of the new…
A new "on the fly" method to perform Born-Oppenheimer ab initio molecular dynamics (AIMD) is presented. Inspired by Ehrenfest dynamics in time-dependent density functional theory, the electronic orbitals are evolved by a Schroedinger-like…
Control of the dynamics of an open quantum system is crucial in quantum information processing. Basically there are two ways: one is the control on the system and the other is tuning the bath parameters. In this paper, we use the latter to…
Entropic dynamics (ED) is a framework that allows one to derive quantum theory as a Hamilton-Killing flow on the cotangent bundle of a statistical manifold. These flows are such that they preserve the symplectic and the (information) metric…
The approach to the analysis of the dynamic of non-equilibrium open systems within the framework of the laws of classical mechanics on the example a hard-disks is offered. This approach was based on Hamilton and Liouville generalized…
The adiabatic approximation in open systems is formulated through the effective Hamiltonian approach. By introducing an ancilla, we embed the open system dynamics into a non-Hermitian quantum dynamics of a composite system, the adiabatic…
The computational bottleneck of molecular dynamics is the pairwise additive long-range interactions between particles. The random batch Ewald (RBE) method provides a highly efficient and superscalable solver for long-range interactions, but…
In the Entropic Dynamics (ED) framework quantum theory is derived as an application of entropic methods of inference. The physics is introduced through appropriate choices of variables and of constraints that codify the relevant physical…
We investigate a stochastic approach to non-equilibrium quantum spin systems based on recent insights linking quantum and classical dynamics. Exploiting a sequence of exact transformations, quantum expectation values can be recast as…
The Non-Markovian Stochastic Schrodinger Equation (NMSSE) offers a promising approach for open quantum simulations, especially in large systems, owing to its low scaling complexity and suitability for parallel computing. However, its…
We build on the concept of eigenvector continuation to develop an efficient multi-state method for the rigorous and smooth interpolation of a small training set of many-body wavefunctions through chemical space at mean-field cost. The…
We point out that two of the most important theorems of Quantum Mechanics, the Ehrenfest theorem and the Hellmann-Feynman theorem, lack in their standard form important information: there are cases where non-Hermitian boundary contributions…
Hybrid quantum-classical algorithms are among the most promising systems to implement quantum computing under the Noisy-Intermediate Scale Quantum (NISQ) technology. In this paper, at first, we investigate a quantum dynamics algorithm for…
We introduce a versatile method to compute electronic steady state properties of strongly correlated extended quantum systems out of equilibrium. The approach is based on dynamical mean-field theory (DMFT), in which the original system is…