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María J López
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Selective Propene Epoxidation on Immobilized Au6–10 Clusters: The Effect of Hydrogen and Water on Activity and Selectivity
S Lee, LM Molina, MJ López, JA Alonso, B Hammer, B Lee, S Seifert, ...
Angewandte Chemie International Edition 48 (8), 1467-1471, 2009
2872009
Enhancement of hydrogen physisorption on graphene and carbon nanotubes by Li doping
I Cabria, MJ López, JA Alonso
The Journal of chemical physics 123 (20), 204721, 2005
2782005
Interaction of molecular and atomic hydrogen with (5, 5) and (6, 6) single-wall carbon nanotubes
JS Arellano, LM Molina, A Rubio, MJ López, JA Alonso
The Journal of chemical physics 117 (5), 2281-2288, 2002
2442002
The optimum average nanopore size for hydrogen storage in carbon nanoporous materials
I Cabria, MJ López, JA Alonso
Carbon 45 (13), 2649-2658, 2007
1922007
Novel polygonized single-wall carbon nanotube bundles
MJ Lopez, A Rubio, JA Alonso, LC Qin, S Iijima
Physical review letters 86 (14), 3056, 2001
1462001
Structural and dynamical properties of Cu–Au bimetallic clusters
MJ López, PA Marcos, JA Alonso
The Journal of chemical physics 104 (3), 1056-1066, 1996
1461996
Theoretical study of the transition from planar to three-dimensional structures of palladium clusters supported on graphene
I Cabria, MJ López, JA Alonso
Physical Review B 81 (3), 035403, 2010
1352010
Electronic and atomic structure of Na, Mg, Al and Pb clusters
MP Iñiguez, MJ Lopez, JA Alonso, JM Soler
Zeitschrift für Physik D Atoms, Molecules and Clusters 11 (2), 163-174, 1988
1191988
Adsorption and Dissociation of Molecular Hydrogen on Palladium Clusters Supported on Graphene
I Cabria, MJ López, S Fraile, JA Alonso
The Journal of Physical Chemistry C 116 (40), 21179-21189, 2012
1062012
Density functional calculations of hydrogen adsorption on boron nanotubes and boron sheets
I Cabria, MJ López, JA Alonso
Nanotechnology 17 (3), 778, 2006
1062006
From graphene oxide to pristine graphene: revealing the inner workings of the full structural restoration
R Rozada, JI Paredes, MJ López, S Villar-Rodil, I Cabria, JA Alonso, ...
Nanoscale 7 (6), 2374-2390, 2015
1022015
Fragmentation of atomic clusters: A theoretical study
MJ López, J Jellinek
Physical Review A 50 (2), 1445, 1994
941994
Magnetic moments of Ni clusters
F Aguilera-Granja, S Bouarab, MJ López, A Vega, ...
Physical Review B 57 (19), 12469, 1998
801998
Density functional study of molecular hydrogen coverage on carbon nanotubes
I Cabria, MJ Lopez, JA Alonso
Computational materials science 35 (3), 238-242, 2006
772006
Simulation of the hydrogen storage in nanoporous carbons with different pore shapes
I Cabria, MJ López, JA Alonso
International Journal of Hydrogen Energy 36 (17), 10748-10759, 2011
752011
Hydrogen storage in pure and Li-doped carbon nanopores: Combined effects of concavity and doping
I Cabria, MJ López, JA Alonso
The Journal of chemical physics 128 (14), 144704, 2008
752008
Molecular-dynamics study of the structural rearrangements of Cu and Au clusters softly deposited on a Cu (001) surface
FJ Palacios, MP Iniguez, MJ López, JA Alonso
Physical Review B 60 (4), 2908, 1999
711999
Palladium Clusters Anchored on Graphene Vacancies and Their Effect on the Reversible Adsorption of Hydrogen
MJ López, I Cabria, JA Alonso
The Journal of Physical Chemistry C 118 (10), 5081-5090, 2014
702014
Analysis of the bonding and reactivity of H and the cluster using density functional concepts
A Mañanes, F Duque, F Méndez, MJ López, JA Alonso
The Journal of chemical physics 119 (10), 5128-5141, 2003
692003
Hydrogen storage capacities of nanoporous carbon calculated by density functional and Møller-Plesset methods
I Cabria, MJ López, JA Alonso
Physical Review B 78 (7), 075415, 2008
672008
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Articles 1–20