Concepedia

Dissociation of ammonia on a copper surface and the effect of oxygen coadsorption: a quantum-chemical study

G.J.C.S. van de Kerkhof, W. Biemolt, A.P.J. Jansen, Rutger A. van Santen

Surface Science · 1993 · 23 citations · 17 references

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References

17

Density-functional exchange-energy approximation with correct asymptotic behavior

Axel D. Becke · Physical review. A, General physics · 1988 · 53.5K citations

, , +17

Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis

S. H. Vosko, L. Wilk, Marwan Nusair · Canadian Journal of Physics · 1980 · 20.7K citations · Full text

, , +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

Self-consistent molecular Hartree—Fock—Slater calculations I. The computational procedure

Evert Jan Baerends, D. E. Ellis, P. Ros · Chemical Physics · 1973 · 3.2K citations

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On the calculation of bonding energies by the Hartree Fock Slater method

Tom Ziegler, Arvi Rauk · Theoretical Chemistry Accounts · 1977 · 2.4K citations

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