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Listar Artículos (Química Orgánica y Farmacéutica) por autor "Sánchez Marcos, Enrique"
Mostrando ítems 1-4 de 4
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Artículo
Collecting high-order interactions in an effective pairwise intermolecular potential using the hydrated ion concept: The hydration of Cf3+
Galbis Fuster, Elsa; Hernández Cobos, Jorge; Rodríguez Pappalardo, Rafael; Sánchez Marcos, Enrique (American Institute of Physics Publising LLC, 2014)This work proposes a new methodology to build interaction potentials between a highly charged metal cation and water ...
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Artículo
Identifying Coordination Geometries of Metal Aquaions in Water: Application to the Case of Lanthanoid and Actinoid Hydrates
Morales, Noelia; Galbis Fuster, Elsa; Martínez Fernández, José Manuel; Rodríguez Pappalardo, Rafael; Sánchez Marcos, Enrique (American Chemical Society, 2016)The angular distribution function (ADF) associated with the oxygen-metal ion-oxygen angle (OMO) of several trivalent ...
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Artículo
Molecular solids of actinide hexacyanoferrate: Structure and bonding
Dupouy, G.; Dumas, T.; Fillaux, C.; Guillaumont, D.; Moisy, P.; Den Auwer, C.; Galbis Fuster, Elsa; Rodríguez Pappalardo, Rafael; Sánchez Marcos, Enrique (IOP Publishing, 2010)The hexacyanometallate family is well known in transition metal chemistry because the remarkable electronic delocalization ...
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Artículo
Solving the Hydration Structure of the Heaviest Actinide Aqua IonKnown: The Californium(III) Case
Galbis Fuster, Elsa; Hernández Cobos, Jorge; den Auwer, Christophe; Le Naour, Ciaire; Guillaumont, Dominique; Simoni, Eric; Rodríguez Pappalardo, Rafael; Sánchez Marcos, Enrique (Wiley-Blackwell, 2010)Wish they all could be californium: X-ray absorption spectroscopy (black points) and Monte Carlo simulations (blue line) ...