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A theoretical study of c-C5H8 adsorption on Ge (001)-2×1 and on dimer vacancies on the surface: Electronic structure and bonding
E. Germán, I. López-Corral, A. Juan, G. Brizuela
Applied Surface Science , 256 (21) , 6237-6245 • 2010
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Cyclopentene (c-C5H8) adsorption on Si(001)-2×1 and on dimer vacancies on the surface: A theoretical study of the electronic structure and chemical bonding
E. Germán, I. López-Corral, A. Juan, G. Brizuela
Computational Materials Science , 49 (4) , 888-894 • 2010
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Effects of potassium on the adsorption of methanol on β-Mo2C(001) surface
C. Pistonesi, A. Juan, A.P. Farkas, F. Solymosi
Surface Science , 604 (11-12) , 914-919 • 2010
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Electronic and bonding properties of MgH2–Nb containing vacancies
C.R. Luna, C.E. Macchi, A. Juan, A. Somoza
International Journal of Hydrogen Energy , 35 (22) , 12421-12427 • 2010
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Hydrogen Storage in AB2 Laves Phase (A = Zr, Ti; B = Ni, Mn, Cr, V): Binding Energy and Electronic Structure
S. B. Gesari, M. E. Pronsato, A. Visintin, A. Juan
The Journal of Physical Chemistry C , 114 (39) , 16832-16836 • 2010
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Multiple hydrogen location in a vacancy region of a FCC iron–nickel-based alloy
S. Simonetti, G. Brizuela, A. Juan
Molecular Physics , 108 (1) , 79-86 • 2010
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Study of the 1.25Cr–1Mo–0.25V steel microstructure after a carburization phenomenon
S. Simonetti, C. Lanz, G. Brizuela, A. Juan
Materials Science and Engineering: A , 527 (21-22) , 5755-5760 • 2010
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Study of the adsorption, electronic structure and bonding of C2H4 on the FeNi(111) surface
S. Simonetti, G. Brizuela, A. Juan
Applied Surface Science , 256 (21) , 6459-6465 • 2010
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The effects of a hydrogen pair in the electronic structure of the FCC iron containing a vacancy
S. Simonetti, D. Rey Saravia, G. Brizuela, A. Juan
International Journal of Hydrogen Energy , 35 (11) , 5957-5962 • 2010
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The influence of Mg on the C adsorption on Ni(100): A DFT study
Hernán Milberg, Alfredo Juan, Norma Amadeo, Beatriz Irigoyen
Journal of Molecular Catalysis A: Chemical , 315 (2) , 171-177 • 2010