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The bound and resonance states along with corresponding autoionization widths for nitrogen sulphide (NS) molecule are determined using electron NS$^+$ cation scattering calculations. The calculations are performed for $^2{\Sigma}^+$,…

Instrumentation and Methods for Astrophysics · Physics 2024-05-01 F. Iacob , T. Meltzer , J. Zs. Mezei , I. F. Schneider , J. Tennyson

A new general formalism for determining the electric multipole polarizabilities of quantum (atomic and nuclear) bound systems based on the use of the transition matrix in momentum space has been developed. As distinct from the conventional…

Nuclear Theory · Physics 2012-08-08 V. F. Kharchenko

We present a hybrid quantum classical neural network that can be trained to perform electronic structure calculation and generate potential energy curves of simple molecules. The method is based on the combination of parameterized quantum…

Quantum Physics · Physics 2020-07-31 Rongxin Xia , Sabre Kais

Using the eigenchannel R-matrix method we calculate partial photoionization cross sections from the ground state of the helium atom for incident photon energies up to the N=9 manifold. The wide energy range covered by our calculations…

Atomic Physics · Physics 2009-11-07 Tobias Schneider , Chien-Nan Liu , Jan-Michael Rost

Bound states of hyperbolic potential is investigated by means of a generalized pseudospectral method. Significantly improved eigenvalues, eigenfunctions are obtained efficiently for arbitrary $n, \ell$ quantum states by solving the relevant…

Chemical Physics · Physics 2015-06-22 Amlan K. Roy

We discuss the automatic solution of the multichannel Schr\"odinger equation. The proposed approach is based on the use of a CP method for which the step size is not restricted by the oscillations in the solution. Moreover, this CP method…

Numerical Analysis · Mathematics 2014-06-24 Veerle Ledoux , Marnix Van Daele

The problem of quantum state preparation is one of the main challenges in achieving the quantum advantage. Furthermore, classically, for multi-level problems, our ability to solve the corresponding quantum optimal control problems is rather…

The potential energy curves for molecular ions up to $N_2^{4+}$ are calculated in an ab initio manner using the multi configurational self-consistent field method. Specifically, we implement in an automatic way a previously used double loop…

Atomic Physics · Physics 2023-07-26 Antonis Hadjipittas , Agapi Emmanouilidou

Accurate ro-vibrational energies, eigenfunctions, radial densities, expectation values are presented for the exponential-type Manning-Rosen (MR) potential. Bound states accurate up to ten significant figure are obtained by employing a…

Atomic Physics · Physics 2015-06-22 Amlan K. Roy

In this contribution, we introduce numerical continuation methods and bifurcation theory, techniques which find their roots in the study of dynamical systems, to the problem of tracing the parameter dependence of bound and resonant states…

Mathematical Physics · Physics 2011-11-23 Przemysław Kłosiewicz , Jan Broeckhove , Wim Vanroose

We propose an analytical approach for computing the eigenspectrum and corresponding eigenstates of a hyperbolic double well potential of arbitrary height or width, which goes beyond the usual techniques applied to quasi-exactly solvable…

Quantum Physics · Physics 2021-01-01 D. Kufel , H. Chomet , C. Figueira de Morisson Faria

An alternative approximation scheme has been used in solving the Schrodinger equation for the exponential-cosine-screened Coulomb potential. The bound state energ\i es for various eigenstates and the corresponding wave functions are…

Quantum Physics · Physics 2007-05-23 Sameer M. Ikhdair , Ramazan Sever

This paper presents a novel and efficient approach for the computation of energy eigenvalues in quantum semiconductor heterostructures. Accurate determination of the electronic states in these heterostructures is crucial for understanding…

Mesoscale and Nanoscale Physics · Physics 2024-06-18 J. D. Phan , A. -V. Phan

This is the first in a series of articles in which we study the rotating Morse potential model for diatomic molecules in the tridiagonal J-matrix representation. Here, we compute the bound states energy spectrum by diagonalizing the finite…

Chemical Physics · Physics 2011-11-10 I. Nasser , M. S. Abdelmonem , H. Bahlouli , A. D. Alhaidari

We present a polymer quantization of the -lambda/r^2 potential on the positive real line and compute numerically the bound state eigenenergies in terms of the dimensionless coupling constant lambda. The singularity at the origin is handled…

General Relativity and Quantum Cosmology · Physics 2009-05-26 G. Kunstatter , J. Louko , J. Ziprick

The goal of this paper is to calculate bound, resonant and scattering states in the coupled-channel formalism without relying on the boundary conditions at large distances. The coupled-channel solution is expanded in eigenchannel bases i.e.…

Nuclear Theory · Physics 2014-01-13 R. M. Id Betan

The problem of quantum particle moving in Dirac delta potential with instant changing well depth is studied by using formalism of tomographic representation of quantum mechanics.The bound state tomogram is given in terms of error…

Quantum Physics · Physics 2013-08-12 I. V. Dudinetc , V. I. Manko

We derive analytic expressions of the recursive solutions to the Schr\"{o}dinger's equation by means of a cutoff potential technique for one-dimensional piecewise constant potentials. These solutions provide a method for accurately…

Quantum Physics · Physics 2015-06-26 Hwasung Lee , Y. J. Lee

Single-particle resonance parameters and wave functions in spherical and deformed nuclei are determined through analytic continuation in the potential strength. In this method, the analyticity of the eigenvalues and eigenfunctions of the…

Nuclear Theory · Physics 2009-11-06 G. Cattapan , E. Maglione

Bound states of the power-law and logarithmic potentials are calculated using a generalized pseudospectral method. The solution of the single-particle Schr\"odinger equation in a nonuniform and optimal spatial discretization offers accurate…

Quantum Physics · Physics 2015-06-16 Amlan K. Roy
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