Related papers: Born-Oppenheimer approximation for an atom in cons…
It has been assumed that it is possible to approximate the interactions of quantized BPS solitons by quantising a dynamical system induced on a moduli space of soliton parameters. General properties of the reduction of quantum systems by a…
We develop a phase-space electronic structure theory of molecules in magnetic fields. For a system of electrons in a magnetic field with vector potential $\bf{A}(\hat{\bf{r}})$, the usual Born-Oppenheimer Hamiltonian is the sum of the…
The Born-Oppenheimer approach to the matter-gravity system is illustrated and the unitary evolution for matter, in the absence of phenomena such as tunnelling or other instabilities, verified. The Born-Oppenheimer approach to the…
A detailed study of the lowest states $1s_0, 2p_{-1}, 2p_0$ of the hydrogen atom placed in a magnetic field $B\in(0-4.414\times 10^{13} {\rm G})$ and their electromagnetic transitions ($1s_{0} \leftrightarrow 2p_{-1}$ and $ 1s_{0}…
We give a new reduction of a general diatomic molecular Hamiltonian, without modifying it near the collision set of nuclei. The resulting effective Hamiltonian is the sum of a smooth semiclassical pseudodifferential operator (the…
We consider free atoms and ions in $\R^3$ interacting with the quantized electromagnetic field. Because of the translation invariance we consider the reduced hamiltonian associated with the total momentum. After introducing an ultraviolet…
In this paper, we consider the time-dependent Born-Oppenheimer approximation (BOA) of a classical quantum molecule involving a possibly large number of nuclei and electrons, described by a Schr\"odinger equation. In the spirit of Born and…
It is known that, within the Born-Oppenheimer approximation, the slow modes of the nuclear motion are altered by three effects that emerge from integrating out the fast modes of the electronic motion. The first is an effective scalar…
We propose a new variational quantum algorithm, which we refer to as TIMES-ADAPT, that prepares time-evolved states in a low-energy or symmetric subspace of a time-independent Hamiltonian on a quantum computer. Using a specially trained…
We apply the Born--Oppenheimer approximation to a harmonic diatomic molecule with one electron. We compare the exact and approximate results not only for the internal degrees of freedom but also for the motion of the center of mass. We…
This paper is the first in a series aimed at understanding the long-term evolution of neutron star magnetic fields. We model the stellar matter as an electrically neutral and lightly ionized plasma composed of three moving particle species:…
We study the $\lambda \phi^4$ field theory in a flat Robertson-Walker space-time using the functional Sch\"odinger picture. We introduce a simple Gaussian approximation to analyze the time evolution of pure states and we establish the…
While Born-Oppenheimer molecular dynamics (BOMD) has been widely studied by resorting to powerful methods in mathematical analysis, this paper presents a geometric formulation in terms of Hamilton's variational principle and…
We resurrect a standard construction of analytical mechanics dating from the last century. The technique allows one to pass from any dynamical system whose first order evolution equations are known, and whose bracket algebra is not…
We generalize the standard Born-Oppenheimer approximation to the case of open quantum systems. We define the zeroth order Born-Oppenheimer approximation of an open quantum system as the regime in which its effective Hamiltonian can be…
Interactions between a source of light and atoms are ubiquitous in nature. The study of them is interesting on the fundamental level as well as for applications. They are in the core of Quantum Information Processing tasks and in Quantum…
A numerical method of calculating the non-Markovian evolution of a driven atom radiating into a structured continuum is developed. The formal solution for the atomic reduced density matrix is written as a Markovian algorithm by introducing…
We first carry out the soliton sector quantization of the spatially cut-off $\phi^4_{1+1}$ theory with double well potential in the semiclassical limit, deriving the nonrelativistic Schr\"odinger equation as an equation describing the…
For linear bose field theories, I show that if a classical Hamiltonian function is strictly positive, then there is a canonical transformation making the evolution orthogonal. This structure theorem is used to analyze the corresponding…
We extend the systematic calculation of an approximately relativistic Hamiltonian for centre of mass and internal dynamics of an electromagnetically bound two-particle system by Sonnleitner and Barnett [1] to the case including a weak…