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Matches in SemOpenAlex for { <https://semopenalex.org/work/W1995295512> ?p ?o ?g. }

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• W1995295512 abstract "This work carries out a study of atomic valences within molecular systems based on Mulliken and topological population analyses at correlated level. The use of the unpaired electron densities leads to suitable relationships between valences, free valence indices, and bond indices, which turn out to be quite useful for computational purposes. The results arising from both methods at correlated and uncorrelated levels are compared in a large series of chemical compounds. Several interesting conclusions are drawn out and analyzed in detail." @default.
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• W1995295512 date "2003-09-22" @default.
• W1995295512 modified "2023-10-18" @default.
• W1995295512 title "Determination of atomic valence indices from population analyses at correlated level" @default.
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• W1995295512 doi "https://doi.org/10.1002/jcc.10368" @default.
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