José Manuel
López Rodríguez
Publicaciones en las que colabora con José Manuel López Rodríguez (30)
2013
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An Orbital Free ab initio Method: Applications to Liquid Metals and Clusters
Recent Progress in Orbital-free Density Functional Theory (World Scientific Publishing Co.), pp. 55-145
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Electronic shell and dynamical coexistence effects in the melting of aluminum clusters: An interpretation of the calorimetric experiments through computer simulation
Journal of Physical Chemistry Letters, Vol. 4, Núm. 14, pp. 2397-2403
2012
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Neutral and charged gallium clusters: Structures, physical properties and implications for the melting features
Nanoscale, Vol. 4, Núm. 20, pp. 6481-6492
2011
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Identifying structural and energetic trends in isovalent core-shell nanoalloys as a function of composition and size mismatch
Journal of Chemical Physics, Vol. 135, Núm. 13
2010
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Activation of dinitrogen by solid and liquid aluminum nanoclusters: A combined experimental and theoretical study
Journal of the American Chemical Society, Vol. 132, Núm. 37, pp. 12906-12918
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Structure determination in 55-atom Li-Na and Na-K nanoalloys
Journal of Chemical Physics, Vol. 133, Núm. 9
2009
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Atomic layering and related postmelting effects in small liquid metal clusters
Physical Review B - Condensed Matter and Materials Physics, Vol. 79, Núm. 16
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Electronic effects on melting: Comparison of aluminum cluster anions and cations
Journal of Chemical Physics, Vol. 131, Núm. 4
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Structures and stabilities of Aln+, Aln, and Aln- (n=13-34) clusters
Journal of Chemical Physics, Vol. 130, Núm. 6
2008
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Correlation between the latent heats and cohesive energies of metal clusters
Journal of Chemical Physics, Vol. 129, Núm. 14
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Substituting a copper atom modifies the melting of aluminum clusters
Journal of Chemical Physics, Vol. 129, Núm. 12
2007
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Chapter 3 Computer simulation of the solid-liquid phase transition in alkali metal nanoparticles
Theoretical and Computational Chemistry, Vol. 18, pp. 59-83
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Melting transition in rotating sodium clusters
Journal of Computational Methods in Sciences and Engineering, Vol. 7, Núm. 5-6, pp. 339-353
2006
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First-principles structures and stabilities of AlN+ (N = 46-62) clusters
Journal of Physical Chemistry B, Vol. 110, Núm. 29, pp. 14020-14023
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Molecular dynamics simulation of the melting-like transition in K 1Na54
Computational Materials Science
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Small sodium clusters that melt gradually: Melting mechanisms in Na30
Physical Review B - Condensed Matter and Materials Physics, Vol. 74, Núm. 11
2005
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Anomalous size dependence in the melting temperatures of free sodium clusters: An explanation for the calorimetry experiments
Physical Review Letters, Vol. 94, Núm. 23
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Melting-like transition in a ternary alkali nanoalloy: Li 13Na30Cs12
Journal of Chemical Theory and Computation, Vol. 1, Núm. 2, pp. 299-306
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Molecular dynamics simulations of the meltinglike transition in Li 13Na 42 and Na 13Cs 42 clusters
Physical Review B - Condensed Matter and Materials Physics, Vol. 71, Núm. 7
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Structural and thermal behavior of compact core-shell nanoparticles: Core instabilities and dynamic contributions to surface thermal stability
Physical Review B - Condensed Matter and Materials Physics, Vol. 72, Núm. 20