Convergence Properties of Certain Formulas for Multicenter Electron Repulsion Integrals Obtained from the Bipolar Expansion of r12−1
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1671015
Reference3 articles.
1. New Aspects of the Bipolar Expansion and Molecular Multicenter Integrals
2. Analytical Evaluation of Multicenter Integrals of r12− 1 with Slater‐Type Atomic Orbitals. I. (1‐2)‐Type Three‐Center Integrals
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1. On the computation of (2-2) three-center Slater-type orbital integrals of 1/r12 using Fourier-transform-based analytical formulas;International Journal of Quantum Chemistry;2004
2. Two-centre Coulomb integrals over STOs from analytical evaluation of k-integrals by contour integration in the complex plane;Chemical Physics Letters;1990-04
3. Two-center molecular repulsion integrals over slater functions;International Journal of Quantum Chemistry;1990-01
4. A generalized multipole expansion for molecular interactions;Molecular Physics;1989-08-20
5. Spherical-Harmonic Expansion Techniques for Multicenter Integrals over STO’s. A Re-Examination for Vector Processing Computers;ETO Multicenter Molecular Integrals;1982
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