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Rys quadrature scheme

In the Rys-quadrature scheme presented above, the one- and two-dimensional integrals were calculated using the McMurchie-Davidson scheme. These integrals may also be obtained from the Obara-Saika scheme, as we shall now discuss. [Pg.395]

See other pages where Rys quadrature scheme is mentioned: [Pg.405]   
See also in sourсe #XX -- [ Pg.26 ]



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