Related papers: Born-Oppenheimer approximation for a harmonic mole…
Predominantly, harmonic oscillator single-particle wave functions are the choice as a basis in ab-initio nuclear many-body calculations. These wave-functions, although very convenient in order to evaluate the matrix elements of the…
A method based on the envelope theory is presented to compute approximate solutions for $N$-body Hamiltonians with identical particles in $D$ dimensions ($D\ge 2$). In some favorable cases, the approximate eigenvalues can be analytically…
We consider the motion of a harmonically trapped overdamped particle, which is submitted to a self-phoretic force, that is proportional to the gradient of a diffusive field for which the particle itself is the source. In agreement with…
Molecule-optimized basis sets, based on approximate natural orbitals, are developed for accelerating the convergence of quantum calculations with strongly correlated (multi-referenced) electrons. We use a low-cost approximate solution of…
In this work we develop an approach to obtain analytical expressions for potentials in an impenetrable box. It is illustrated through the particular cases of the harmonic oscillator and the Coulomb potential. In this kind of system the…
A soliton ensemble is a particular kind of approximation of the solution of an initial-value problem for an integrable equation by a reflectionless potential that is well adapted to singular asymptotics like the small-dispersion limit. We…
The present paper discusses the diffusion approximation of the linear Boltzmann equation in cases where the collision frequency is not uniformly large in the spatial domain. Our results apply for instance to the case of radiative transfer…
Linear-time invariant (LTI) oscillation systems such as forced mechanical vibration, series RLC and parallel RLC circuits can be solved by using simplest initial conditions or employing of Green's function of which knowledge of initial…
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…
A Lagrangian generalization of time-reversible Born-Oppenheimer molecular dynamics [Niklasson et al., Phys. Rev. Lett. vol. 97, 123001 (2006)] is proposed. The Lagrangian includes extended electronic degrees of freedom as auxiliary…
We propose a method to perform precision measurements of the interaction parameters in systems of N ultra-cold spin 1/2 atoms. The spectroscopy is realized by first creating a coherent spin superposition of the two relevant internal states…
We consider a molecular aggregate consisting of $N$ identical monomers. Each monomer comprises two electronic levels and a single harmonic mode. The monomers interact with each other via dipole-dipole forces. The monomer vibrational modes…
This paper introduces Bohmian mechanics (BM) into the intense laser-atom physics to study high-order harmonic generation. In BM, the trajectories of atomic electrons in intense laser field can be obtained with the Bohm-Newton equation. The…
The Quasi-harmonic (QH) approximation uses harmonic vibrational frequencies omega(H,Q,V), computed at volumes V near the volume where the Born-Oppenheimer (BO) energy is minimum. When this is used in the harmonic free energy, QH…
A variational solution procedure is reported for the many-particle no-pair Dirac-Coulomb-Breit Hamiltonian aiming at a parts-per-billion (ppb) convergence of the atomic and molecular energies, described within the fixed nuclei…
We consider a neutral bosonic molecule in the Born-Oppenheimer approximation without spin and assume the physically obvious assertion that a neutral molecule prefers to break into smaller neutral clusters. We prove the existence of a global…
The properties of asymmetric nuclear matter have been investigated in a relativistic Dirac-Brueckner-Hartree-Fock framework using the Bonn A potential. The components of the self-energies are extracted by projecting on Lorentz invariant…
We present a novel method to solve the spatially homogeneous and isotropic relativistic Boltzmann equation. We employ a basis set of orthogonal polynomials dynamically adapted to allow for emergence of chemical non-equilibrium. Two time…
Exact solutions of the Bohr Hamiltonian with a five-dimensional square well potential, in isolation or coupled to a fermion by the five-dimensional spin-orbit interaction, are considered as examples of a new class of dynamical symmetry or…
In an atomic gas near a Feshbach resonance, the energy of two colliding atoms is close to the energy of a bound state, i.e., a molecular state, in a closed channel that is coupled to the incoming open channel. Due to the different spin…