Concepedia

Steric control of dioxygen activation pathways for Mn<sup>II</sup> complexes supported by pentadentate, amide-containing ligands

Joshua D. Parham, Gayan B. Wijeratne, Jaycee R. Mayfield, Timothy A. Jackson

Dalton Transactions · 2019 · 12 citations · 60 references

DOIFull text

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Concepts

Abstract

formation. Taken together, these observations highlight the use of steric effects as a means to select which intermediates form along dioxygen activation pathways.

References

60

Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations

, , +13

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 100.1K citations

, , +17

Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy

Florian Weigend, Reinhart Ahlrichs · Physical Chemistry Chemical Physics · 2005 · 29.9K citations

, , +15

Density-functional approximation for the correlation energy of the inhomogeneous electron gas

John P. Perdew · Physical review. B, Condensed matter · 1986 · 18.7K citations

, , +11

A new mixing of Hartree–Fock and local density-functional theories

Axel D. Becke · The Journal of Chemical Physics · 1993 · 16.4K citations

, , +11