J
J. M. Gomez Llorente
Researcher at University of La Laguna
Publications - 59
Citations - 875
J. M. Gomez Llorente is an academic researcher from University of La Laguna. The author has contributed to research in topics: Fullerene & Phase space. The author has an hindex of 17, co-authored 58 publications receiving 828 citations. Previous affiliations of J. M. Gomez Llorente include University of Southern California.
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Journal ArticleDOI
Classical Dynamics Methods for High Energy Vibrational Spectroscopy
J. M. Gomez Llorente,Eli Pollak +1 more
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Global potential energy minima of C60(H2O)n clusters.
TL;DR: In most cases, the geometrical substructure of the water molecules in the C60(H2O)n global minimum coincides with that of the corresponding free water cluster, and this qualitative picture does not change significantly if the authors use the TIP3P model for the water-water interaction.
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Confinement Effects on Water Clusters Inside Carbon Nanotubes
TL;DR: In this article, the effects of confinement on water clusters inside nonmetallic carbon nanotubes with radii ranging between 4 and 7.5 A have been computationally investigated by means of global optimization and finite temperature simulations.
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Global Potential Energy Minima of (H2O)n Clusters on Graphite
TL;DR: In this paper, the potential energy surface of graphite is constructed using the TIP4P intermolecular potentials for the water molecules, a Lennard-Jones water−graphite potential, and a water-graphite polarization potential that is built from classical electrostatic image methods.
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Modeling water clusters on cationic carbonaceous seeds.
TL;DR: The Dang-Chang many-body polarizable potential has been used to model the interaction between water molecules and a cationic carbonaceous molecule X(+), and some thermodynamical and dynamical manifestations of the nonwetting behavior are discussed.