General subroutines for the calculation
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J.P. Hansen
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Article
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1990
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Elsevier Science
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English
โ 400 KB
Fourier transform method for calculation of atomic and molecular two-centre integrals is programmed in Fortran, using algebraic manipulation techniques. The subroutines can be directly included in numerical codes and provide efficient and general methods for the calculation of two-centre integrals f