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Published in 2019 at "Theoretical Chemistry Accounts"
DOI: 10.1007/s00214-019-2526-y
Abstract: The calculations of bimetallic complexes of the type (X)[(Ind)M2(L)2] (M = Ni, Pd, L = CO, (PEt3) and X = Allyl, Cp and indenyl) have been done using two DFT functionals, namely BP86 and B3LYP*. The allyl, Cp and indenyl ligands…
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Keywords:
ind;
indenyl;
pet3 allyl;
metal ... See more keywords