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Published in 2020 at "Theoretical Chemistry Accounts"
DOI: 10.1007/s00214-020-2569-0
Abstract: Bond orders are attributed a new role in rationalizing the electronegativity equalization (ENE) and maximum hardness (MH) rules. The following rules and theorems are formulated for chemical species (atoms, groups, molecules), X, Y, XY, their…
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Keywords:
hardness;
electronegativity equalization;
bond;
bond orders ... See more keywords