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The implementation of the orbital minimization method (OMM) for solving the self-consistent Kohn-Sham (KS) problem for electronic structure calculations in a basis of non-orthogonal numerical atomic orbitals of finite-range is reported. We…

Computational Physics · Physics 2014-02-06 Fabiano Corsetti

We present a new parallel numerical method for solving the non-stationary Schr\"odinger equation with linear nonlocal condition and time-dependent potential which does not commute with the stationary part of the Hamiltonian. The given…

Numerical Analysis · Mathematics 2018-09-21 Dmytro Sytnyk

A self-consistent renormalization scheme suitable for the calculation of non-universal quantities in $n$-vector models with pair spin interactions of arbitrary extent has been suggested. The method has been based on the elimination of the…

Statistical Mechanics · Physics 2019-04-24 V. I. Tokar

We study non-local exchange and scattering operators arising in domain decomposition algorithms for solving elliptic problems on domains in $\mathbb{R}^2$. Motivated by recent formulations of the Optimized Schwarz Method introduced by…

Numerical Analysis · Mathematics 2025-04-09 Thomas Beck , Yaiza Canzani , Jeremy L. Marzuola

We propose a numerical method to approximate the scattering amplitudes for the elasticity system with a non-constant matrix potential in dimensions $d=2$ and $3$. This requires to approximate first the scattering field, for some incident…

Numerical Analysis · Mathematics 2021-07-27 Juan A. Barceló , Carlos Castro

Nonlocal coordinate space optical potentials for the scattering of 65 MeV protons from nuclei ranging in mass from 6Li to 238U have been defined by folding a complex, medium dependent effective interaction with the density matrix elements…

Nuclear Theory · Physics 2008-11-26 P. J. Dortmans , K. Amos , S. Karataglidis , J. Raynal

We construct a microscopic optical potential including breakup effects for elastic scattering of weakly-binding projectiles within the Glauber model, in which a nucleon-nucleus potential is derived by the $g$-matrix folding model. The…

Nuclear Theory · Physics 2019-04-23 Shoya Ogawa , Ryo Horinouchi , Masakazu Toyokawa , Takuma Matsumoto

We show how the measurement induced model of quantum computation proposed by Raussendorf and Briegel [Phys. Rev. Letts. 86, 5188 (2001)] can be adapted to a nonlinear optical interaction. This optical implementation requires a Kerr…

Quantum Physics · Physics 2015-06-26 G. D. Hutchinson , G. J. Milburn

Predicting the optical response of macroscopic arrangements of individual scatterers is a computational challenge, as the problem involves length scales across multiple orders of magnitude. We present a full-wave optical method to highly…

Recently, the Asymptotic Iteration Method (AIM) was used to calculate the energy spectrum for a short rang three parameter central potential which was introduced by H. Bahlouli and A. D. Alhaidari. The S-orbital wave solution of the…

Quantum Physics · Physics 2018-02-14 Abdulla Jameel Sous , M. I. El-Kawni

Petaflop architectures are currently being utilized efficiently to perform large scale computations in Atomic, Molecular and Optical Collisions. We solve the Schr\"odinger or Dirac equation for the appropriate collision problem using the…

Atomic Physics · Physics 2015-01-15 Brendan M. McLaughlin , Connor P. Ballance , Michael S. Pindzola , Alfred Müller

The operator product expansion (OPE) is applied in conjunction with Pionless effective field theory to study the short-rang structure of nuclei. By matching the OPE with the selected nuclear potentials for nucleon-nucleon scattering states,…

Nuclear Theory · Physics 2025-07-29 Jiexin Yu , Bingwei Long

We present a new extension of the UKRmol electron-molecule scattering code suite, which allows one to compute ab initio photoionization and photorecombination amplitudes for complex molecules, resolved both on the molecular alignment…

Chemical Physics · Physics 2014-02-18 Alex G Harvey , Danilo S Brambila , Felipe Morales , Olga Smirnova

We have developed a scattering-matrix approach for numerical calculation of resonant states and Q-values of a nonideal optical disk cavity of an arbitrary shape and of an arbitrary varying refraction index. The developed method has been…

Optics · Physics 2009-11-10 A. I. Rahachou , I. V. Zozoulenko

We study one-dimensional optical wave turbulence described by the 1D Schr{\"o}dinger-Helmholtz model for nonlinear light propagation in spatially nonlocal nonlinear optical media such as nematic liquid crystals. By exploiting the specific…

Optics · Physics 2024-12-19 Clément Colléaux , Jonathan Skipp , Jason Laurie , Sergey Nazarenko

Bethe-Salpeter equation is applied to $p$-$n$ elastic scattering. The spin observables are calculated by the M matrix similar to $p$-$p$ case. The parameters of the meson-exchange model are used with the cut-off for the pion exchange…

Nuclear Theory · Physics 2016-04-05 Susumu Kinpara

Low-energy cross sections for elastic scattering and recoil of protons from $^4$He nuclei (also known as $\alpha$ particles) are calculated directly by solving the Schr\"odinger equation for five nucleons interacting through accurate two-…

Nuclear Theory · Physics 2014-12-17 Guillaume Hupin , Sofia Quaglioni , Petr Navrátil

A new approach is described to the evaluation of the S-matrix in three-dimensional atom-diatom reactive quantum scattering theory. The theory is developed based on natural collision coordinates where progress along the reaction coordinate…

Chemical Physics · Physics 2007-05-23 Ashot S. Gevorkyan , Gabriel G. Balint-Kurti , Gunnar Nyman

Contrary to praxis, we provide an analytical expression, for a physical locally periodic structure, of the average $\langle S\rangle$ of the scattering matrix, called optical $S$ matrix in the nuclear physics jargon, and fundamentally…

Statistical Mechanics · Physics 2017-11-28 V. Domínguez-Rocha , R. A. Méndez-Sánchez , M. Martínez-Mares , A. Robledo

We investigate the nonlocality in microscopic optical potentials derived from chiral effective field theory. For this purpose we employ the Perey-Buck ansatz, which connects the energy dependence of purely local optical potentials to a…

Nuclear Theory · Physics 2025-09-11 Laina M. Stahulak , Jeremy W. Holt
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