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We present a super-high-efficiency approximate computing scheme for series sum and discrete Fourier transform. The summation of a series sum or a discrete Fourier transform is approximated by summing over part of the terms multiplied by…

Numerical Analysis · Mathematics 2013-12-09 Xin-Zhong Yan

The Fourier transform is approximated over a finite domain using a Riemann sum. This Riemann sum is then expressed in terms of the discrete Fourier transform, which allows the sum to be computed with a fast Fourier transform algorithm more…

Numerical Analysis · Mathematics 2015-08-07 Jeremy Axelrod

With a super-high-efficient numerical algorithm, we are able to self-consistently calculate the Green's function in the renormalized-ring-diagram approximation for a two-dimensional electron system with long-range Coulomb interactions. The…

Strongly Correlated Electrons · Physics 2011-11-09 Xin-Zhong Yan , C. S. Ting

A modified Green operator is proposed as an improvement of Fourier-based numerical schemes commonly used for computing the electrical or thermal response of heterogeneous media. Contrary to other methods, the number of iterations necessary…

Materials Science · Physics 2014-08-22 François Willot , Bassam Abdallah , Yves-Patrick Pellegrini

Calculations of the Fourier transform of a constant quantity over an area or volume defined by polygons (connected vertices) are often useful in modeling wave scattering, or in fourier-space filtering of real-space vector-based volumes and…

Numerical Analysis · Mathematics 2021-04-20 Brian B. Maranville

By a novel reciprocal space analysis of the measurement, we report a calibrated in situ observation of the bunching effect in a 3D ultracold gas. The calibrated measurement with no free parameters confirms the role of the exchange symmetry…

Quantum Gases · Physics 2013-07-08 A. Blumkin , S. Rinott , R. Schley , A. Berkovitz , I. Shammass , J. Steinhauer

The exchange-correlation hole and potential of the homogeneous electron gas have been investigated within the random-phase approximation, employing the plasmon-pole approximation for the linear density response function. The angular…

Strongly Correlated Electrons · Physics 2023-04-12 K. Karlsson , F. Aryasetiawan

The decay properties of the one-particle Green function in real space and imaginary time are systematically studied for solids. I present an analytic solution for the homogeneous electron gas at finite and at zero temperature as well as…

Materials Science · Physics 2007-05-23 Arno Schindlmayr

Electronic structure calculations are routinely carried out within the framework of density-functional theory, often with great success. For electrons in reduced dimensions, however, there is still a need for better approximations to the…

Strongly Correlated Electrons · Physics 2009-09-22 S. Pittalis , E. Rasanen , E. K. U. Gross

The knowledge of a series expansion of the equation of state provides a deep insight into the physical nature of a quantum system. Starting from a generic ``perturbative'' equation of state of a homogeneous ultracold gas we make predictions…

Strongly Correlated Electrons · Physics 2009-11-11 G. E. Astrakharchik

We derive a local approximation for the correlation energy in two-dimensional electronic systems. In the derivation we follow the scheme originally developed by Colle and Salvetti for three dimensions, and consider a Gaussian approximation…

Strongly Correlated Electrons · Physics 2008-11-21 S. Pittalis , E. Rasanen , M. Marques

We study normal state properties of an interacting Fermi gas in an isotropic harmonic trap of arbitrary dimensions. We exactly calculate the first-order perturbation terms in the ground state energy and chemical potential, and obtain simple…

Statistical Mechanics · Physics 2009-11-07 Hiroyuki Yoshimoto , Susumu Kurihara

We present an accurate local density-functional for electronic-structure calculations within the density functional theory (DFT). The functional is derived by analyzing the structure of the standard perturbative expansion of the correlation…

Materials Science · Physics 2024-11-28 Mario Benites , Angel Rosado , Efstratios Manousakis

We investigate numerically efficient approximations of eigenspaces associated to symmetric and general matrices. The eigenspaces are factored into a fixed number of fundamental components that can be efficiently manipulated (we consider…

Machine Learning · Computer Science 2021-09-29 Cristian Rusu , Lorenzo Rosasco

Employing a local formula for the electron-electron interaction energy, we derive a self-consistent approximation for the total energy of a general $N$-electron system. Our scheme works as a local variant of the Thomas-Fermi approximation…

Chemical Physics · Physics 2013-10-31 E. Rasanen , A. Odriazola , I. Makkonen , A. Harju

The dynamic response of an interacting electron system is determined by an extension of the relaxation-time approximation forced to obey local conservation laws for number, momentum and energy. A consequence of these imposed constraints is…

Strongly Correlated Electrons · Physics 2009-11-07 G. S. Atwal , N. W. Ashcroft

Calculations of excited states in Green's function formalism often invoke the diagonal approximation, in which the quasiparticle states are taken from a mean-field calculation. Here, we extend the stochastic approaches applied in the…

Computational Physics · Physics 2023-09-28 Annabelle Canestraight , Xiaohe Lei , Khaled Ibrahim , Vojtech Vlcek

We provide an approach to implementing the shallow atmosphere approximation in three dimensional finite element discretisations for dynamical cores. The approach makes use of the fact that the shallow atmosphere approximation metric can be…

Numerical Analysis · Mathematics 2014-10-14 C. J. Cotter , D. A. Ham , A. T. T. McRae , L. Mitchell , A. Natale

We present a calculation of the spectral properties of a single charge doped at a Cu($3d$) site of the Cu-F plane in KCuF$_{3}$. The problem is treated by generating the equations of motion for the Green's function by means of subsequent…

Strongly Correlated Electrons · Physics 2016-12-26 Krzysztof Bieniasz , Mona Berciu , Andrzej M. Oleś

We derive a generalized gradient approximation to the exchange energy to be used in density functional theory calculations of two-dimensional systems. This class of approximations has a long and successful history, but it has not yet been…

Strongly Correlated Electrons · Physics 2009-01-07 S. Pittalis , E. Rasanen , J. G. Vilhena , M. A. L. Marques
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