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We obtain simple formulas for the matrix elements of the resolvent operator (the Green's function) in any finite set of square integrable basis. These formulas are suitable for numerical computations whether the basis elements are…

Quantum Physics · Physics 2025-01-22 A. D. Alhaidari

The objective of this work is the introduction and investigation of favourable time integration methods for the Gross--Pitaevskii equation with rotation term. Employing a reformulation in rotating Lagrangian coordinates, the equation takes…

Numerical Analysis · Mathematics 2019-10-29 Philipp Bader , Sergio Blanes , Fernando Casas , Mechthild Thalhammer

We present a detailed account of the GW space-time method. The method increases the size of systems whose electronic structure can be studied with a computational implementation of Hedin's GW approximation. At the heart of the method is a…

Condensed Matter · Physics 2009-10-31 M. M. Rieger , L. Steinbeck , I. D. White , H. N. Rojas , R. W. Godby

Efficient computation of lattice defect geometries such as point defects, dislocations, disconnections, grain boundaries, interfaces and free surfaces requires accurate coupling of displacements near the defect to the long-range elastic…

Materials Science · Physics 2013-08-06 Joseph A. Yasi , Dallas R. Trinkle

We introduce a numerical method for the solution of the time-dependent Schrodinger equation with a smooth potential, based on its reformulation as a Volterra integral equation. We present versions of the method both for periodic boundary…

Numerical Analysis · Mathematics 2021-08-03 Jason Kaye , Alex Barnett , Leslie Greengard

Here we present a detailed account of the fundamental problems one encounters in projection theory when non-orthogonal basis sets are used for representation of the operators. In particular, we re-examine the use of projection operators in…

Mesoscale and Nanoscale Physics · Physics 2015-06-19 M. Soriano , J. J. Palacios

The Green's functions of QCD encode important information about the infrared dynamics of the theory. The main non-perturbative tools used to study them are their own equations of motion, known as Schwinger-Dyson equations, and large-volume…

High Energy Physics - Phenomenology · Physics 2014-11-20 Joannis Papavassiliou

The semiclassical Schr\"odinger equation with time-dependent potentials is an important model to study electron dynamics under external controls in the mean-field picture. In this paper, we propose two multiscale finite element methods to…

Computational Engineering, Finance, and Science · Computer Science 2019-09-17 Jingrun Chen , Sijing Li , Zhiwen Zhang

Hagedorn functions are carefully constructed generalizations of Hermite functions to the setting of many-dimensional squeezed and coupled harmonic systems. Wavepackets formed by superpositions of Hagedorn functions have been successfully…

Quantum Physics · Physics 2025-08-18 Jiří J. L. Vaníček , Zhan Tong Zhang

We present two methods for computing two-time correlation functions or Green's functions from real time bold-line continuous time quantum Monte Carlo. One method is a formally exact generalized auxiliary lead formalism by which spectral…

Strongly Correlated Electrons · Physics 2014-04-01 Guy Cohen , David R. Reichman , Andrew J. Millis , Emanuel Gull

Two-particle Green's functions and the vertex functions play a critical role in theoretical frameworks for describing strongly correlated electron systems. However, numerical calculations at two-particle level often suffer from large…

Strongly Correlated Electrons · Physics 2018-05-16 Hiroshi Shinaoka , Junya Otsuki , Kristjan Haule , Markus Wallerberger , Emanuel Gull , Kazuyoshi Yoshimi , Masayuki Ohzeki

The exact reduced density-matrix functional is derived from the Luttinger-Ward functional of the single-particle Green's function. Thereby, a formal link is provided between diagrammatic many-body approaches using Green's functions on the…

Strongly Correlated Electrons · Physics 2013-12-11 Peter E. Blöchl , Thomas Pruschke , Michael Potthoff

Despite recent advances, systematic quantitative treatment of the electron correlation problem in extended systems remains a formidable task. Systematically improvable Green's function methods capable of quantitatively describing weak and…

Chemical Physics · Physics 2016-11-15 Alexander A. Rusakov , Dominika Zgid

We develop an efficient algorithm for a spatially inhomogeneous matrix-valued quantum Boltzmann equation derived from the Hubbard model. The distribution functions are $2 \times 2$ matrix-valued to accommodate the spin degree of freedom,…

Computational Physics · Physics 2015-05-15 Jianfeng Lu , Christian B. Mendl

An algorithm for the numerical solution of the Schr\"odinger equation in the case of a time dependent potential is proposed. Our simple modification upgrades the well known method of Koonin while negligibly increasing the computing time. In…

Nuclear Theory · Physics 2009-10-28 R. Schaefer , R. Blendowske

We consider several models of the damped oscillators in nonrelativistic quantum mechanics in a framework of a general approach to the dynamics of the time-dependent Schroedinger equation with variable quadratic Hamiltonians. The Green…

Mathematical Physics · Physics 2009-06-04 Ricardo Cordero-Soto , Erwin Suazo , Sergei K. Suslov

We extend the formalism of the thermodynamic two-time Green's functions to nonextensive quantum statistical mechanics. Working in the optimal Lagrangian multipliers representation, the $q$-spectral properties and the methods for a direct…

Statistical Mechanics · Physics 2008-09-07 A. Cavallo , F. Cosenza , L. De Cesare

The linear Boltzmann equation with constant coefficients in the three-dimensional infinite space is revisited. It is known that the Green's function can be calculated via the Fourier transform in the case of isotropic scattering. In this…

Mathematical Physics · Physics 2016-04-20 Manabu Machida

Motived by the necessity of explicit and reliable calculations, as a valid contribution to clarify the effectiveness and, possibly, the limits of the Tsallis thermostatistics, we formulate the Two-Time Green Functions Method in nonextensive…

Statistical Mechanics · Physics 2009-11-11 A. Cavallo , F. Cosenza , L. De Cesare

In this work, we generalize previous results about the Fractionary Schr\"{o}dinger Equation within the formalism of the theory of Tempered Ultradistributions. Several examples of the use of this theory are given. In particular we evaluate…

Mathematical Physics · Physics 2015-05-20 A. L. De Paoli , M. C. Rocca
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