On the mathematical nature of Guseinov's rearranged one-range addition theorems for Slater-type functions
DOI10.1007/S10910-011-9914-4zbMATH Open1317.81121arXiv1107.4670OpenAlexW2964160088MaRDI QIDQ424197FDOQ424197
Authors: Ernst Joachim Weniger
Publication date: 31 May 2012
Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)
Full work available at URL: https://arxiv.org/abs/1107.4670
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Cites Work
- NIST handbook of mathematical functions
- Title not available (Why is that?)
- Title not available (Why is that?)
- Title not available (Why is that?)
- Title not available (Why is that?)
- On the analyticity of Laguerre series
- Title not available (Why is that?)
- Title not available (Why is that?)
- Numerical Methods for Special Functions
- On the summation of some divergent hypergeometric series and related perturbation expansions
- Addition theorems for B functions and other exponentially declining functions
- On the eigenfunctions of many-particle systems in quantum mechanics
- Weakly convergent expansions of a plane wave and their use in Fourier integrals
- Analytic Atomic Wave Functions
- Title not available (Why is that?)
- The termination of the afferent nerve fibre in the muscle spindle of the frog
- Title not available (Why is that?)
- Mean Convergence of Expansions in Laguerre and Hermite Series
- Title not available (Why is that?)
- Title not available (Why is that?)
- On the connection coefficients and recurrence relations arising from expansions in series of Laguerre polynomials
- How well does the Hermite-Padé approximation smooth the Gibbs phenomenon?
- Summation of divergent power series by means of factorial series
- Development of non-linear transformations for improving convergence of sequences
- Generalization of Laplace's Expansion to Arbitrary Powers and Functions of the Distance between Two Points
- Title not available (Why is that?)
- On a Device for Computing the e m (S n ) Transformation
- Title not available (Why is that?)
- Extrapolation algorithms for filtering series of functions, and treating the Gibbs phenomenon
- Title not available (Why is that?)
- Title not available (Why is that?)
- Prediction proberties of Aitken's iterated \(\Delta^2\) process, of Wynn's epsilon algorithm, and of Brezinski's iterated theta algorithm
- Large parameter cases of the Gauss hypergeometric function
- Expansion formulae for two-center integer and noninteger \(n\) STO charge densities and their use in evaluation of multi-center integrals
- A matrix representation of the translation operator with respect to a basis set of exponentially declining functions
- Rational approximations for the modified Bessel function of the second kind
- Extrapolation methods for improving the convergence of oligomer calculations to the infinite chain limit of quasi-one-dimensional stereoregular polymers.
- The \(\varepsilon\)-algorithm allows to detect Dirac delta functions.
- Analytical evaluation of multicenter multielectron integrals of central and noncentral interaction potentials over Slater orbitals using overlap integrals and auxiliary functions
- Evaluation of multicenter electronic attraction, electric field and electric field gradient integrals with screened and nonscreened Coulomb potentials over integer and noninteger \(n\) Slater orbitals
- Comment on ``Calculation of two-center nuclear attraction integrals over integer and noninteger \(n\)-Slater-type orbitals in nonlined-up coordinate systems
- Use of unsymmetrical one-range addition theorems of Slater type orbitals in molecular electronic structure determination
- Calculation of multicenter electronic attraction, electric field and electric field gradient integrals of Coulomb potential over integer and noninteger \(n\) Slater orbitals
- Evaluation of two- and three-center overlap integrals over complete orthonormal sets of \(\Psi^\alpha\)-ETOs using their addition theorems
- Use of recursion and analytical relations in evaluation of hypergeometric functions arising in multicenter integrals with noninteger \(n\) Slater type orbitals
- One-range addition theorems for combined Coulomb and Yukawa like central and noncentral interaction potentials and their derivatives
- Numerical evidence that the perturbation expansion for a non-Hermitian \(\mathcal{PT}\)-symmetric Hamiltonian is Stieltjes
- Title not available (Why is that?)
- Combined theory of two-electron nonrelativistic and quasirelativistic multicenter integrals over integer and noninteger \(n\) slater type orbitals using auxiliary functions \(Q^q_{ns}\) and \(G^q_{-ns}\)
- Title not available (Why is that?)
- Padé summability of the cubic oscillator
- New representations for the spherical tensor gradient and the spherical delta function
- Every Power Series is a Taylor Series
- Anomalous Convergence of a Continued Fraction for Ratios of Kummer Functions
- The summation of the ordinary and renormalized perturbation series for the ground state energy of the quartic, sextic, and octic anharmonic oscillators using nonlinear sequence transformations
- Unified analytical treatment of multicentre electron attraction, electric field and electric field gradient integrals over Slater orbitals
- UNIFORM ASYMPTOTIC EXPANSIONS FOR HYPERGEOMETRIC FUNCTIONS WITH LARGE PARAMETERS I
- UNIFORM ASYMPTOTIC EXPANSIONS FOR HYPERGEOMETRIC FUNCTIONS WITH LARGE PARAMETERS II
- New summation technique for rapidly divergent perturbation series. Hydrogen atom in magnetic field
- Numerical aspects of special functions
- Unified treatment of complex and real rotation-angular functions for two-center overlap integrals over arbitrary atomic orbitals
- Unified treatment of complete orthonormal sets of functions in coordinate, momentum and four-dimensional spaces and their expansion and one-range addition theorems
- Accurate evaluation of overlap integrals of Slater type orbitals with noninteger principal quantum numbers using complete orthonormal sets of \(Y^{a}\) - exponential type orbitals
- Unified treatment of complete orthonormal sets of nonrelativistic, quasirelativistic and relativistic sets of spinor wave functions, and Slater spinor orbitals in coordinate, momentum and four-dimensional spaces
- Unified treatment of complete orthonormal sets for wave functions, and Slater orbitals of particles with arbitrary spin in coordinate, momentum and four-dimensional spaces
- Title not available (Why is that?)
- EVALUATION OF ONE- AND TWO-ELECTRON MULTICENTER INTEGRALS OF YUKAWA-LIKE SCREENED CENTRAL AND NONCENTRAL INTERACTION POTENTIALS OVER SLATER ORBITALS USING ADDITION THEOREMS
- New Developments in Molecular Orbital Theory
- Integrals Occurring in Problems of Molecular Structure
- Integrals of the paramagnetic contribution in the relativistic calculation of the shielding tensor
- Evaluation of potential of electric field produced by molecule using symmetrical one-range addition theorems for Coulomb-Yukawa like correlated interaction potentials of integer and noninteger indices
- Theory of complete orthonormal sets of relativistic tensor wave functions and Slater tensor orbitals of particles with arbitrary spin in position, momentum and four-dimensional spaces
- Interpolation between sequence transformations
- Is the recurrence relation for orthogonal polynomials always stable?
- Use of auxiliary functions \({Q_{ns}^q}\) and \({G_{-ns}^q}\) in evaluation of multicenter integrals over integer and noninteger \(n\)-Slater type orbitals arising in Hartree-Fock-Roothaan equations for molecules
- Unified treatment of nonrelativistic and quasirelativistic atomic integrals over complete orthonormal sets of \(\Psi^\alpha\) -exponential type orbitals
- Theory of complete orthonormal relativistic vector wave function sets and Slater type relativistic vector orbitals in coordinate, momentum and four-dimensional spaces
- Application of combined open shell Hartree-Fook-Roothaan theory to molecules using symmetrical one-range addition theorems of Slater type orbitals
- Expansion formulae for two-center charge densities of integer and noninteger \(n\) generalized exponential type orbitals applied to evaluation of multicenter multielectron integrals
- Combined theory of two- and four-component complete orthonormal sets of spinor wave functions and Slater type spinor orbitals in position, momentum and four-dimensional spaces
- Reduction of the Gibbs phenomenon for smooth functions with jumps by the \(\varepsilon \)-algorithm
- Use of Cartesian coordinates in evaluation of multicenter multielectron integrals over Slater type orbitals and their derivatives
- On the unified treatment of complete orthonormal sets of functions in coordinate, momentum, and four dimensional spaces and their expansion and one-range addition theorems
- Unified treatment of complete orthonormal sets for exponential type vector orbitals of particles with spin 1 in coordinate, momentum and four-dimensional spaces
- Bessel, sine and cosine functions and extrapolation methods for computing molecular multi-center integrals
- Evaluation of intermolecular interaction energy using one-range addition theorems for \({\psi ^\alpha}\)-ETO and Coulomb-Yukawa like correlated interaction potentials with integer and noninteger indices
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