Concepedia

Olefin hydrogenation using diimine pyridine complexes of Co and Rh

Q. Knijnenburg, Andrew D. Horton, Harry van der Heijden, T.M. Kooistra, Dennis G. H. Hetterscheid, J.M.M. Smits, Bas de Bruin, Peter H. M. Budzelaar, A.W. Gal

Journal of Molecular Catalysis A Chemical · 2005 · 141 citations · 24 references

DOI

Concepts

References

24

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

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

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

, , +11

Fully optimized contracted Gaussian basis sets for atoms Li to Kr

Ansgar Schäfer, Hans W. Horn, Reinhart Ahlrichs · The Journal of Chemical Physics · 1992 · 9.6K citations

, , +11

Electronic structure calculations on workstation computers: The program system turbomole

Reinhart Ahlrichs, Michael Bär, Marco Häser et al. · Chemical Physics Letters · 1989 · 8.5K citations

, , +9