相关论文: On the Born-Oppenheimer approximation of diatomic …

We derive the Hamiltonian for cold fermionic atoms in an optical lattice across a broad Feshbach resonance, taking into account of both multiband occupations and neighboring-site collisions. Under typical configurations, the resulting…

An approximate relativistic two-component Hamiltonian for use in molecular electronic structure calculations is derived in the form of a sum of fixed atom-centered kinetic and spin-orbit operators added to the non-relativistic Hamiltonian.…

We present the saddle-point approximation for the effective Hamiltonian of the quantum kink in two-dimensional linear sigma models to all orders in the time-derivative expansion. We show how the effective Hamiltonian can be used to obtain…

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…

The quantum mechanical motion of the atomic nuclei is considered over a single- or a multi-dimensional subspace of electronic states which is separated by a gap from the rest of the electronic spectrum over the relevant range of nuclear…

We construct an abstract pseudodifferential calculus with operator-valued symbol, adapted to the treatment of Coulomb-type interactions, and we apply it to study the quantum evolution of molecules in the Born-Oppenheimer approximation, in…

Symmetry considerations are at the core of the major frameworks used to provide an effective mathematical representation of atomic configurations that is then used in machine-learning models to predict the properties associated with each…

We present the effective Hamiltonian for an electron-nucleus interaction in non-relativistic limit up to the second order in the inverse nucleon mass. This Hamiltonian takes into account the distortion of electron waves and allows to…

We propose a quantum algorithm for inferring the molecular nuclear spin Hamiltonian from time-resolved measurements of spin-spin correlators, which can be obtained via nuclear magnetic resonance (NMR). We focus on learning the anisotropic…

We prove that any symmetric Hamiltonian that is a quadratic function of the coordinates and momenta has a pseudo-Hermitian adjoint or regular matrix representation. The eigenvalues of the latter matrix are the natural frequencies of the…

We construct a non-perturbative approach based on quantum averaging combined with resonant transformations to detect the resonances of a given Hamiltonian and to treat them. This approach, that generalizes the rotating-wave approximation,…

We discuss a general and systematic method for obtaining effective Hamiltonians that describe different nonlinear optical processes. The method exploits the existence of a nonlinear deformation of the usual su(2) algebra that arises as the…

We derive an effective Hamiltonian for the nonlinear process of parametric down conversion in the presence of absorption. Based upon the Green function method for quantizing the electromagnetic field, we first set up Heisenberg's equations…

The purpose of this paper is to show that the operator \begin{equation*} H\left(h\right) =-h^{2}\Delta_{x}-\Delta_{y}+V\left(x,y\right), \end{equation*}% $V$ is continuous (or $V\in L^{2}\left(\mathbb{R}_{x}^{n}\times…

Using the operator formulation we discuss the bosonization of the two-dimensional derivative-coupling model. The fully bosonized quantum Hamiltonian is obtained by computing the composite operators as the leading terms in the Wilson short…

We derive the Hamiltonian in the rotating frame for NMR quantum computing with homonucleus molecules as its computational resource. The Hamiltonian thus obtained is different from conventional Hamiltonians that appear in literature. It is…

We reelaborate on a general method for obtaining effective Hamiltonians that describe different nonlinear optical processes. The method exploits the existence of a nonlinear deformation of the su(2) algebra that arises as the dynamical…

We derive a boson Hamiltonian from a Nuclear Hamiltonian whose potential is expanded in pairing multipoles and determine the fermion-boson mapping of operators. We use a new method of bosonization based on the evaluation of the partition…

We consider Hamiltonians, which are even polynomials of the forth order with the respect to Bose operators. We find subspaces, preserved by the action of Hamiltonian These subspaces, being finite-dimensional, include, nonetheless, states…

We study the semiclassical distribution of resonances of a $2 \times 2$ matrix Schr\"odinger operator, obtained as a reduction of an Hamiltonian when studying molecular predissociation models under the Born-Oppenheimer approximation. The…