相关论文: FERM3D: A finite element R-matrix electron molecul…
We present a multichannel model for elastic interactions, comprised of an arbitrary number of coupled finite square-well potentials, and derive semi-analytic solutions for its scattering behavior. Despite the model's simplicity, it is…
Computational modelling offers a cost-effective and time-efficient alternative to experimental studies in biomedical engineering. In cardiac electro-mechanics, finite element method (FEM)-based simulations provide valuable insights into…
We present Fiend - a simulation package for three-dimensional single-particle time-dependent Schr\"odinger equation for cylindrically symmetric systems. Fiend has been designed for the simulation of electron dynamics under inhomogeneus…
A continuum of excitations in interacting one-dimensional systems is bounded from below by a spectral edge that marks the lowest possible excitation energy for a given momentum. We analyse short-range interactions between Fermi particles…
The aim of this study is to analyze the interaction of charged particles (ions and electrons) with randomly formed particle scatterers (e.g.\ large scale local "magnetic fluctuations" or "coherent magnetic irregularities"), using the set up…
A new near-to-far-field transformation algorithm for three-dimensional finite-different time-domain is presented in this article. This new approach is based directly on the polarization current of the scatterer, not the scattered near…
We present a fast and accurate method to calculate the electrostatic energy and forces of interacting particles with the boundary conditions appropriate to surfaces, i.e periodic in the two directions parallel to the surface and free in the…
The present work reports about the dynamics of a collection of randomly distributed, and randomly oriented, oscillators in 3D space, coupled by an interaction potential falling as $1/r^3$, where r stands for the inter-particle distance.…
The scattering of a charged fermion from an electroweak or semi-local string is investigated and a full solution obtained for both massive and massless cases. For the former, with fractional string flux, there is a helicity conserving and…
We consider a general quantum field relativistic scattering involving two half spin fermions, $A$ and $B$, which are initially entangled with another fermion $C$ that does not participate in the scattering dynamics. We construct general…
A methodology for determining the scattered Electromagnetic (EM) fields present for interconnected regions with common metasurface boundaries is presented. The method uses a Boundary Element Method (BEM) formulation of the frequency domain…
We consider weakly bound diatomic molecules (dimers) formed in a two-component atomic Fermi gas with a large positive scattering length for the interspecies interaction. We develop a theoretical approach for calculating atom-dimer and…
Accurately modelling cold and ultracold reactive collisions occuring over deep potential wells, such as \ce{D+ + H2 -> H+ + HD}, requires the development of new theoretical and computational methodologies. One potentially useful framework…
A recently developed formulation for a direct treatment of the equations for two- and three-nucleon bound states as set of coupled equations of scalar functions depending only on vector momenta is extended to three-nucleon scattering.…
UKRmol+ is a new implementation of the UK R-matrix electron-molecule scattering code. Key features of the implementation are the use of quantum chemistry codes such as Molpro to provide target molecular orbitals; the optional use of mixed…
We present a formalism for the scattering of an arbitrary linear or acyclic branched structure build by joining mutually non-interacting arbitrary functional sub-units. The formalism consists of three equations expressing the structural…
We present application examples of a graphical method for the efficient construction of potential matrix elements in quantum physics or quantum chemistry. The simplicity and power of this method are illustrated through several examples. In…
Scattering of two spinless charge particles for simple forces including coulomb admixtures is calculated without partial wave decomposition. The coulomb interaction being taken is of the type of screened coulomb potential. For the forces…
Three-dimensional (3D) radiative hydrodynamic model atmospheres of metal-poor late-type stars are characterized by cooler upper photospheric layers than their 1D counterparts. This property of 3D models can dramatically affect elemental…
We present a new approach to three-dimensional electromagnetic scattering problems via fast isogeometric boundary element methods. Starting with an investigation of the theoretical setting around the electric field integral equation within…