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We present a quantum theory for the dynamic structure factors in non-equilibrium, correlated, two-component systems such as plasmas or warm dense matter. Using this general framework, we derive expressions for effective local field…
In this paper I will describe a new software package developed using the Java programming language, aimed to compute the positions of any Solar System body (among asteroids, comets, planets, and satellites) to help to perform cross-matches…
We analyse the scattering operator associated with the defocusing nonlinear Schr{\"o}dinger equation which captures the evolution of solutions over an infinite time-interval under the nonlinear flow of this equation. The asymptotic nature…
Proposed silicon-based quantum-computer architectures have attracted attention because of their promise for scalability and their potential for synergetically utilizing the available resources associated with the existing Si technology…
We have developed a Scalable Linear Augmented Slater-Type Orbital (LASTO) method for electronic-structure calculations on free-standing atomic clusters. As with other linear methods we solve the Schr\"odinger equation using a mixed basis…
A phase-space generation algorithm, capable to efficiently integrate the squared amplitude of any scattering process, is presented. The algorithm has been implemented in a Monte Carlo program, PHEGAS, which, using HELAC, a helicity…
The J-matrix method of scattering is used to obtain analytic expressions for the phase shift of two classes of relativistic exponential-type separable potentials whose radial component is either of the general form r^(n-1)exp(-r) or…
Recently, a new approach for solving the three-body problem for (d,p) reactions in the Coulomb-distorted basis in momentum space was proposed. Important input quantities for such calculations are the scattering matrix elements for proton-…
Many areas of science and engineering encounter data defined on spherical manifolds. Modelling and analysis of spherical data often necessitates spherical harmonic transforms, at high degrees, and increasingly requires efficient computation…
Computational chemistry allows researchers to experiment in sillico: by running a computer simulations of a biological or chemical processes of interest. Molecular dynamics with molecular mechanics model of interactions simulates N-body…
Developing a predictive capability for inelastic scattering will find applications in multiple areas. Experimental data for neutron-nucleus inelastic scattering is limited and thus one needs a robust theoretical framework to complement it.…
We report on work using a newly developed code, SpheriCo.jl, that computes the gravitational collapse of a spherical scalar field, where the scalar can be either a classical field, or a quantum field operator. By utilising…
We propose a new scalable platform for quantum computing (QC) -- an array of optically trapped symmetric-top molecules (STMs) of the alkaline earth monomethoxide (MOCH$_3$) family. Individual STMs form qubits, and the system is readily…
This manuscript describes the software package SCOUT, which analyzes, characterizes, and corrects one-dimensional signals. Specifically, it allows to check and correct for stationarity, detect spurious samples, check for normality, check…
This program can be used to simulate polarised nucleon - nucleon collisions at high energies. Spins of colliding particles are taken into account. The program allows to calculate cross sections for various processes.
Stress relaxation and oscillation damping of complex viscoelastic media often manifest history- and path-dependent physical behaviors and cannot accurately be described by the classical models. Recent research found that fractional…
Detailed comparisons are made between results of calculations for intermediate energy nucleon--208Pb scattering using optical potentials obtained from Dirac phenomenology and a microscopic Schrodinger model. The two approaches yield quite…
Studying chemical reactions, particularly in the gas phase, relies heavily on computing scattering matrix elements. These elements are essential for characterizing molecular reactions and accurately determining reaction probabilities.…
This work develops a new open source API and software package called \textit{SymPhas} for simulations of phase-field, phase-field crystal and reaction-diffusion models, supporting up to three dimensions and an arbitrary number of fields.…
Analysis of small angle scattering (SAS) data requires intensive modelling to infer and characterize the structures present in a sample. This iterative improvement of models is a time consuming process. Here we present the Scattering…