Related papers: Effective non-adiabatic Hamiltonians for the quant…
A nonadiabatic scheme for the description of the coupled electron and nuclear motions in the ozone molecule was proposed recently. An initial coherent nonstationary state was prepared as a superposition of the ground state and the excited…
The quantization of the kinetic energy of a deformed nucleus in curvilinear coordinates in the case of octupole oscillations of its surface firstly has been carried out. The obtained form of the Hamiltonian differs from the previously…
In this paper, we derive equations of motion for the normal-order, the symmetric-order and the antinormal-order quantum characteristic functions, applicable for general Hamiltonian systems. We do this by utilizing the `characteristic form'…
Describing systems with non-Hermitian (NH) operators remains a challenge in quantum theory due to instabilities (e.g., exceptional points and decoherence) arising from interactions with the environment. We propose a framework to express the…
Quantum trajectory calculations for electrons are a useful tool in the field of molecular dynamics, e.g. to understand processes in ultrafast spectroscopy. They have, however, two limitation: On the one hand, such calculations are typically…
We consider the quantum dynamics of a single particle in the plane under the influence of a constant perpendicular magnetic and a crossed electric potential field. For a class of smooth and small potentials we construct a non-trivial…
We present a quantum algorithm to obtain the response of the atomic nucleus to a small external electromagnetic perturbation. The Hamiltonian of the system is presented by a harmonic oscillator, and the linear combination of unitaries (LCU)…
We show that the Hamiltonian describing N nonrelativistic electrons with spin, interacting with the quantized radiation field and several fixed nuclei with total charge Z has a ground state when N <Z+1. The result holds for any value of the…
We propose an adiabatic-elimination formalism in the dispersive regime based on a transition-centric perturbation theory. The perturbative expansion is recast into a diagrammatic framework, while adiabatic elimination is implemented through…
Ab initio computations of atomic nuclei, based on Hamiltonians from effective field theories of quantum chromodynamics, are now routinely used to predict and describe properties of medium heavy nuclei, and even the heavy nucleus $^{208}$Pb…
General analytical solutions of the Quantum Hamilton Jacobi Equation for conservative one-dimensional or reducible motion are presented and discussed. The quantum Hamilton's characteristic function and its derivative, i.e. the quantum…
Direct dynamics methods using Gaussian wavepackets have to rely only on local properties, such as gradients and hessians at the center of the wavepacket, so as to be compatible with the usual quantum chemistry methods. Matrix elements of…
Exactly solvable Hamiltonians are useful in the study of quantum many-body systems using quantum computers. In the variational quantum eigensolver, a decomposition of the target Hamiltonian into exactly solvable fragments can be used for…
The paper studies the structure of high-order adiabatic approximation of a wave function for slowly changing Hamiltonians. A constructive technique for explicit separation of fast and slow components of the wave function is developed. The…
Noncommutivity of position and momentum makes it difficult to formulate the unambiguous structure of the kinetic part of Hamiltonian for the position-dependent effective mass (PDEM). Various existing proposals of writing the viable kinetic…
Aim of this paper is to show the possible significance, and usefulness, of various non-selfadjoint operators for suitable Observables in non relativistic and relativistic quantum mechanics, and in quantum electrodynamics. More specifically,…
In this dissertation I analyze Hamiltonian control of $d$-dimensional quantum systems as realized in alkali atomic spins. Alkali atoms provide an ideal platform for studies of quantum control due to the extreme precision with which the…
In this work we show how to engineer bilinear and quadratic Hamiltonians in cavity quantum electrodynamics (QED) through the interaction of a single driven two-level atom with cavity modes. The validity of the engineered Hamiltonians is…
Trajectory-based mixed quantum-classical approaches to coupled electron-nuclear dynamics suffer from well-studied problems such as the lack of (or incorrect account for) decoherence in the trajectory surface hopping method and the inability…
The nonrelativistic Hamiltonians of scalar, spinor and vector particles in the electromagnetic field are studied by applying the Douglas-Kroll-Hess approach. Their relativistic Hamiltonians are expanded on the potential, and the…