Koopmans’ multiconfigurational self-consistent field (MCSCF) Fukui functions and MCSCF perturbation theory

Author: Dmitriev Yuri Yu.   Stoyanov Stanislav R.   Kovalenko Andriy  

Publisher: NRC Research Press

ISSN: 1480-3291

Source: Canadian Journal of Chemistry, Vol.91, Iss.9, 2013-01, pp. : 886-893

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Abstract