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Use of the forced populating of d orbitals to eliminate oscillations during the determination of a self-consistent charge approximation

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Translated from Zhurnal Strukturnoi Khimii, Vol. 27, No. 4, pp. 172–173, July–August, 1986.

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Khleskov, V.I. Use of the forced populating of d orbitals to eliminate oscillations during the determination of a self-consistent charge approximation. J Struct Chem 27, 654–656 (1987). https://doi.org/10.1007/BF00754018

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  • DOI: https://doi.org/10.1007/BF00754018

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