Concepedia

Synthesis, structure, UV–Vis–IR spectra, magnetism and theoretical studies on CuII[(2-aminomethyl)pyridine](thiocyanate)2 and comparisons with an analogous CuII complex

Madhulata Shukla, Nitin Srivastava, Satyen Saha, T.R. Rao, Sailaja S. Sunkari

Polyhedron · 2011 · 45 citations · 46 references

DOI

Concepts

References

46

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

Axel D. Becke · The Journal of Chemical Physics · 1993 · 101.1K 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 · 98.6K citations

, , +14

A short history of<i>SHELX</i>

George M. Sheldrick · Acta Crystallographica Section A Foundations of Crystallography · 2007 · 86.8K citations · Full text

, , +14

Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 61.8K citations · Full text

, , +16

Density-functional exchange-energy approximation with correct asymptotic behavior

Axel D. Becke · Physical review. A, General physics · 1988 · 52.9K citations

, , +17