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Publications in 1993
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Theoretical investigation of CH4 decomposition on Ni:
electronic structure calculations and dynamics. H. Burghgraef,
A.P.J. Jansen and R.A. van Santen, Faraday Discuss. 96,
337-347 (1993)
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NH4+ in zeolites, coordination and solvation
effects. E.H. Teunissen, R.A. van Santen, A.P.J. Jansen, F.B.
van Duijneveldt, J. Phys. Chem. 97, 203-210 (1993)
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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, R.A. van Santen, Surf. Sci.
284, 361-371 (1993)
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Theoretical determination of proton affinity differences in zeolites.
G.J. Kramer, R.A. van Santen, J. Am. Chem. Soc. 115,
2887-2897 (1993)
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Theory of Brønsted Acidity in Zeolites. R.A. van Santen, G.J.
Kramer, W.P.J.H. Jacobs, in Elementary Reaction Steps in Heterogeneous
Catalysis, R.W. Joyner and R.A. van Santen (eds.), Kluwer Academic
Publishers, 113-131 (1993)
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Understanding the acid behaviour of zeolites from theory and experiment.
G.J. Kramer, R.A. van Santen, C.A. Emeis, A.K. Nowak, Nature
363, 529-531 (1993)
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Theoretical investigation of the insertion of nickel in the CH
bond of CH4. Electronic structure calculations and dynamics. H.
Burghgraef, A.P.J. Jansen, R.A. van Santen, J. Chem. Phys.
98(11), 8810-8818 (1993)
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A multiconfiguration time-dependent hartree approximation based
on natural single-particle states. A.P.J. Jansen, J. Chem.
Phys. 99(5), 4055-4063 (1993)
- The oxidation of ammonia by copper. W. Biemolt, A.P.J. Jansen,
M. Neurock, G.J.C.S. van de Kerkhof and R.A. van Santen, Surf. Sci.
287/288, 183-187 (1993)
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