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- W3216173823 abstract "We have developed a McMurchie-Davidson-like recursion formula for efficient evaluation of the Coulomb attraction and interaction matrix elements between two-dimensional primitive Cartesian Gaussian type orbitals. We also present recurrence schemes for combined position and differential operator integrals, and three-center Gaussian integrals. The Cartesian Gaussian orbitals are isotropic in the exponent, but with arbitrary centers and angular momentum." @default.
- W3216173823 created "2021-12-06" @default.
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- W3216173823 date "2021-11-29" @default.
- W3216173823 modified "2023-09-27" @default.
- W3216173823 title "Evaluation of Gaussian integrals for the modeling of two-dimensional quantum systems." @default.
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