The QM/MM approach for wavefunctions, energies and response functions within self-consistent field and coupled cluster theories

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Molecular Physics, Vol. 100, Iss. 11, 2002-06 ,pp. : 1813-1828

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On methods for converging open-shell Hartree-Fock wave-functions

By Guest M.F.   Saunders V.  

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Spin-orbit interactions from self consistent field wavefunctions

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Approximate self-consistent field molecular orbital calculations for valence shell electronic states

By Dixon R.N.  

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The computation of Karplus equation coefficients and their components using self-consistent field and second-order polarization propagator methods

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