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Matches in SemOpenAlex for { <https://semopenalex.org/work/W2141715868> ?p ?o ?g. }

• W2141715868 abstract "A new formalism is presented, based upon the finite element method, that permits a dual representation of orbitals in terms of exponential or Gaussian functions as both an integral over the space of exponential parameters and as a linear combination of basis functions. The method has been implemented for the atomic Hartree-Fock problem using exponential functions and test calculations made for atoms ranging from B to Cl. Accurate and consistent results can be obtained for a variety of atoms in a simple way using computational schemes that are systematic and hierarchic in nature" @default.
• W2141715868 created "2016-06-24" @default.
• W2141715868 creator A5060845694 @default.
• W2141715868 date "1992-12-01" @default.
• W2141715868 modified "2023-09-27" @default.
• W2141715868 title "From linear combinations to integrals: A new approach to the basis function problem" @default.
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• W2141715868 doi "https://doi.org/10.1002/jcc.540131004" @default.
• W2141715868 hasPublicationYear "1992" @default.
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