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The location of a hydrogen atom and hydrogen molecules in BCC Fe: an ASED-MO approach
B Irigoyen, R Ferullo, N Castellani, A Juan
Modelling and Simulation in Materials Science and Engineering , 3 (3) , 319-329 • 1995
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Molecular orbital studies in the MgCl2-ethyl benzoate-TiCl4 system
M.L. Ferreira, A. Juan, N.J. Castellani, D.E. Damiani
Journal of Molecular Catalysis , 87 (2-3) , 137-150 • 1994
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ASED-MO theoretical study of CO adsorption and dissociation on Ru(001) in the presence of Cl or MoO
A Juan, G Brizuela
Journal of Physics: Condensed Matter , 5 (33A) , A231-A232 • 1993
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Theoretical studies of CO adsorption and dissociation on Ru in presence of Cl or MoO x
A. Juan, D. E. Damiani, N. J. Castellani
Catalysis Letters , 19 (1) , 43-53 • 1993
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Alumina-supported Ru-Mo Catalysts for the syngas reaction
A. Juan, D.E. Damiani
Catalysis Today , 15 (3-4) , 469-480 • 1992
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Supported Ru$z.sbnd;Mo catalysts for syngas reaction to oxygenates
A JUAN
Journal of Catalysis , 137 (1) , 77-91 • 1992