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An efficient numerical quadrature is proposed for the approximate calculation of the potential energy in the context of pseudo potential electronic structure calculations with Daubechies wavelet and scaling function basis sets. Our…

Computational Physics · Physics 2009-11-11 A. I. Neelov , S. Goedecker

The complex-scaling method can be used to calculate molecular resonances within the Born-Oppenheimer approximation, assuming the electronic coordinates are dilated independently of the nuclear coordinates. With this method, one will…

Quantum Physics · Physics 2021-06-16 Teng Bian , Sabre Kais

We consider radial complex scaling/perfectly matched layer methods for scalar resonance problems in homogeneous exterior domains. We introduce a new abstract framework to analyze the convergence of domain truncations and discretizations.…

Numerical Analysis · Mathematics 2020-07-21 Martin Halla

We consider a Schroedinger operator on the axis with a bipartite potential consisting of two compactly supported complex-valued functions, whose supports are separated by a large distance. We show that this operator possesses a sequence of…

Mathematical Physics · Physics 2019-10-10 D. I. Borisov , D. A. Zezyulin

We develop the complex scaling method for the Dirichlet Laplacian in a domain with asymptotically cylindrical end. We define resonances as discrete eigenvalues of non-selfadjoint operators, obtained as deformations of the selfadjoint…

Analysis of PDEs · Mathematics 2013-06-24 Victor Kalvin

We report the first application of complex symmetric wavelets to the numerical simulation of a nonlinear signal propagation model. This model is the so-called nonlinear Schrodinger equation that describes, for instance, the evolution of the…

comp-gas · Physics 2008-02-03 L. Gagnon , J. M. Lina , B. Goulard

We demonstrate that Daubechies wavelets can be used to construct a minimal set of optimized localized contracted basis functions in which the Kohn-Sham orbitals can be represented with an arbitrarily high, controllable precision. Ground…

We implement complex scaling of Faddeev equations using hyper-spheric coordinates and adiabatic expansion. Complex scaling of coordinates allows convenient calculations of three-body resonances. We derive the necessary equations and…

Nuclear Theory · Physics 2009-11-10 D. V. Fedorov , E. Garrido , A. S. Jensen

We construct a tridiagonal matrix representation for the three dimensions Dirac-Coulomb Hamiltonian that provides for a simple and straightforward relativistic extension of the complex scaling method. Besides the Coulomb interaction,…

Quantum Physics · Physics 2008-11-26 A. D. Alhaidari

We perform a short review of the history of quantum mechanics, with a focus on the historical problems with describing ionization theoretically in the context of quantum mechanics. The essentials of the theory of resonances are presented.…

Quantum Physics · Physics 2021-03-10 Patrik Pirkola

The complex scaling/perfectly matched layer method is a widely spread technique to simulate wave propagation problems in open domains. The method is very popular, because its implementation is very easy and does not require the knowledge of…

Numerical Analysis · Mathematics 2021-06-29 Martin Halla

The complex scaling method (CSM) is a useful similarity transformation of the Schr\"odinger equation, in which bound-state spectra are not changed but continuum spectra are separated into resonant and non-resonant continuum ones. Because…

Nuclear Theory · Physics 2014-10-17 Takayuki Myo , Yuma Kikuchi , Hiroshi Masui , Kiyoshi Kato

We develop a general approach to study three-dimensional Schroedinger operators with confining potentials depending on the distance to a surface. The main idea is to apply parallel coordinates based on the surface but outside its cut locus…

Mathematical Physics · Physics 2025-02-05 David Krejcirik , Jan Kriz

The approximation of the eigenvalues and eigenfunctions of an elliptic operator is a key computational task in many areas of applied mathematics and computational physics. An important case, especially in quantum physics, is the computation…

Numerical Analysis · Mathematics 2018-08-31 Douglas Arnold , Guy David , Marcel Filoche , David Jerison , Svitlana Mayboroda

We improve the complex scaling method (CSM) to obtain virtual states, which were previously challenging in the conventional CSM. Our approach solves the Schr\"odinger equation in the momentum space as an eigenvalue problem by choosing the…

High Energy Physics - Phenomenology · Physics 2024-02-22 Yan-Ke Chen , Lu Meng , Zi-Yang Lin , Shi-Lin Zhu

Quantum computing has been increasingly applied in nuclear physics. In this work, we combine quantum computing with the complex scaling method to address the resonance problem. Due to the non-Hermiticity introduced by complex scaling,…

Nuclear Theory · Physics 2024-09-11 Hantao Zhang , Dong Bai , Zhongzhou Ren

This paper presents the exact ground state solution for a diatomic particle system with position-dependent complex mass under action of a complex Morse potential in the quantum domain. By solving the position-dependent Schr\"odinger…

Quantum Physics · Physics 2025-12-24 Partha Sarathi , Bhaskar Singh Rawat

We use Lorentz polynomials to present the solutions explicitly of equations (6.1.7) of [I. Daubechies, Ten lectures on wavelets, CBMS-NSF Regional Conference Series in Applied Mathematics, 61. Society for Industrial and Applied Mathematics…

Functional Analysis · Mathematics 2015-07-14 Tian-Xiao He , Tung Nguyen

The complex scaling method (CSM) provides with a way to obtain resonance parameters of particle unstable states by rotating the coordinates and momenta of the original Hamiltonian. It is convenient to use an L$^2$ integrable basis to…

Nuclear Theory · Physics 2016-11-21 G. Papadimitriou

We use variable transformation from the real line to finite or semi-infinite spaces where we expand the regular solution of the 1D time-independent Schrodinger equation in terms of square integrable bases. We also require that the basis…

Quantum Physics · Physics 2022-06-20 E. El Aaoud , H. Bahlouli , A. D. Alhaidari
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