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The \textsc{Greens} library is presented which provides a set of C++ procedures for the computation of the (radial) Coulomb wave and Green's functions. Both, the nonrelativistic as well as relativistic representations of these functions are…

Atomic Physics · Physics 2008-02-06 Peter Koval , Stephan Fritzsche

The cumulant expansion is a powerful approach for including correlation effects in electronic structure calculations beyond the GW approximation. However, current implementations are incomplete since they ignore terms that lead to partial…

Strongly Correlated Electrons · Physics 2014-02-04 J. J. Kas , J. J. Rehr , L. Reining

First derivatives with respect to the parameters of the Whittaker function $\mathrm{W}_{\kappa ,\mu }\left( x\right) $ are calculated. Using the confluent hypergeometric function, these derivarives can be expressed as infinite sums of…

Classical Analysis and ODEs · Mathematics 2023-04-28 Alexander Apelblat , Juan Luis González-Santander

First derivatives of the Whittaker function $\mathrm{M}_{\kappa ,\mu }\left(x\right) $ with respect to the parameters are calculated. Using the confluent hypergeometric function, these derivarives can be expressed as infinite sums of…

Classical Analysis and ODEs · Mathematics 2023-04-28 Alexander Apelblat , Juan Luis González-Santander

The renewed Green's function approach to calculating the angular Fock coefficients, $\psi_{k,p}(\alpha,\theta)$ is presented. The final formulas are simplified and specified to be applicable for analytical as well as numerical calculations.…

Atomic Physics · Physics 2017-05-26 Evgeny Liverts , Nir Barnea

We evaluate the Green's function of the D-dimensional relativistic Coulomb system via sum over perturbation series which is obtained by expanding the exponential containing the potential term $V({\bf x)}$ in the path integral into a power…

Quantum Physics · Physics 2008-11-26 De-Hone Lin

We calculate the Green function for the Dirac equation describing a spin 1/2 particle in the presence of a potential which is a sum of the Coulomb potential V_C=-A_1/r and a Lorentz scalar potential V_S=-A_2/r. The bound state spectrum is…

High Energy Physics - Theory · Physics 2007-05-23 Arvind Narayan Vaidya , Luiz Eduardo Silva Souza

The cumulant expansion of the Green's function is a computationally efficient beyond-$GW$ approach renowned for its significant enhancement of satellite features in materials. In contrast to the ubiquitous $GW$ approximation of many-body…

Chemical Physics · Physics 2024-02-27 Pierre-François Loos , Antoine Marie , Abdallah Ammar

Summation formulas are obtained for products of associated Lagurre polynomials by means of the Green's function K for the Hamiltonian H = -{d^2\over dx^2} + x^2 + Ax^{-2}, A > 0. K is constructed by an application of a Mercer type theorem…

Mathematical Physics · Physics 2009-11-11 Attila B. von Keviczky , Nasser Saad , Richard L. Hall

Higher Green functions are real-valued functions of two variables on the upper half plane which are bi-invariant under the action of a congruence subgroup, have logarithmic singularity along the diagonal, but instead of the usual equation…

Number Theory · Mathematics 2008-04-22 Anton Mellit

A method is given to obtain the Green's function for the Poisson equation in any arbitrary integer dimension under periodic boundary conditions. We obtain recursion relations which relate the solution in d-dimensional space to that in…

Mathematical Physics · Physics 2009-11-11 Sandeep Tyagi

A new algorithm to calculate Coulomb wave functions with all of its arguments complex is proposed. For that purpose, standard methods such as continued fractions and power/asymptotic series are combined with direct integrations of the…

Computational Physics · Physics 2009-11-13 N. Michel

In principle, the Luttinger-Ward Green's function formalism allows one to compute simultaneously the total energy and the quasiparticle band structure of a many-body electronic system from first principles. We present approximate and exact…

Materials Science · Physics 2015-05-18 Sohrab Ismail-Beigi

Uniform $L^1$ and lower bounds are obtained for the Green's function on compact K\"ahler manifolds. Unlike in the classic theorem of Cheng-Li for Riemannian manifolds, the lower bounds do not depend directly on the Ricci curvature, but only…

Differential Geometry · Mathematics 2022-02-11 Bin Guo , Duong H. Phong , Jacob Sturm

Using the operator method, the Green's functions of the Dirac and Klein-Gordon equations in the Coulomb potential $-Z\alpha/r$ are derived for the arbitrary space dimensionality $d$. Nonrelativistic and quasiclassical asymptotics of these…

Atomic Physics · Physics 2016-11-30 R. N. Lee , A. I. Milstein , I. S. Terekhov

Quantum mechanical scalar particle with polarizability is considered in the presence of the Coulomb field. Separation of variables is performed with the use of Wigner $D$-functions, the radial system of 15 equations is reduced to a single…

Mathematical Physics · Physics 2011-09-16 V. Kisel , G. Krylov , E. Ovsiyuk , M. Amirfachrian , V. Red'kov

The Stieltjes constants $\gamma_k(a)$ appear as the coefficients in the regular part of the Laurent expansion of the Hurwitz zeta function $\zeta(s,a)$ about $s=1$. We present the evaluation of $\gamma_1(a)$ and $\gamma_2(a)$ at rational…

Complex Variables · Mathematics 2014-05-20 Mark W. Coffey

Let $\gamma$ denote imaginary parts of complex zeros of the Riemann zeta-function $\zeta(s)$. Certain sums over the $\gamma$'s are evaluated, by using the function $G(s) = \sum_{\gamma>0}\gamma^{-s}$ and other techniques. Some integrals…

Number Theory · Mathematics 2007-05-23 Aleksandar Ivić

The determination of ultra-long-range molecular potential curves has been reformulated using the Coulomb Greens function to give a solution in terms of the roots of an analytical determinantal equation. For a system consisting of one…

Atomic Physics · Physics 2025-11-25 Chris H. Greene , Matthew T. Eiles

An orthogonality relation for the Whittaker functions of the second kind of imaginary order, $W_{\kappa,\mathrm{i}\mu}(x)$, with $\mu\in\mathbb{R}$, is investigated. The integral $\int_{0}^{\infty}\mathrm{d}x\:…

Classical Analysis and ODEs · Mathematics 2009-10-13 Radoslaw Szmytkowski , Sebastian Bielski
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