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  • 1
    Electronic Resource
    Electronic Resource
    Springer
    Theoretical chemistry accounts 59 (1981), S. 629-637 
    ISSN: 1432-2234
    Keywords: Electronegativity ; Valence states ; CNDO
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology
    Notes: Abstract A generalization of the original method introduced by Hinze and Jaffé for calculating the orbital electronegativities is proposed. This generalization is based on a new energy partitioning scheme within the framework of CNDO approximation and permits the orbital electronegativities to be calculated for atoms in actual valence states in which they occur in real molecules.
    Type of Medium: Electronic Resource
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