Concepedia

Studies of the adsorption of acetaldehyde, methyl acetate, ethyl acetate, and methyl trifluoroacetate on silica

M.A. Natal-Santiago, Josephine M. Hill, James A. Dumesic

Journal of Molecular Catalysis A Chemical · 1999 · 57 citations · 34 references

DOI

Concepts

References

34

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

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

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Ab initio molecular orbital theory

Warren J. Hehre · Accounts of Chemical Research · 1976 · 7.9K citations

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Density Functional Theory of Electronic Structure

W. Kohn, Axel D. Becke, Robert G. Parr · The Journal of Physical Chemistry · 1996 · 3.4K citations

, , +17

Using redundant internal coordinates to optimize equilibrium geometries and transition states

Chunyang Peng, Philippe Y. Ayala, H. Bernhard Schlegel et al. · Journal of Computational Chemistry · 1996 · 2.7K citations

, , +12

FT-IR study of the adsorption and transformation of formaldehyde on oxide surfaces

Guido Busca, J. Lamotte, J.C. Lavalley et al. · Journal of the American Chemical Society · 1987 · 628 citations

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