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Issue DateTitleAuthor(s)
6-Dec-2021Molecular Approach to Alkali-Metal Encapsulation by a Prussian Blue Analogue FeII/CoIII Cube in Aqueous Solution: A Kineticomechanistic Exchange StudyGonzálvez, Miguel A.; Bernhardt, Paul V.; Font Bardia, Ma. Mercedes; Gallen Ortiz, Albert; Jover Modrego, Jesús; Ferrer García, Montserrat; Martínez López, Manuel, 1957-
28-Dec-2020Fragment Dissolved molecular dynamics: A systematic and efficient method to locate binding sites.Privat-Contreras, Cristian; Granadino Roldán, José M.; Bonet, Jordi; Santos Tomas, M.; Pérez González, Juan J.; Rubio Martínez, Jaime
7-Aug-2020Spin dynamics in single-molecule magnets and molecular qubitsAravena Ponce, Daniel Alejandro; Ruiz Sabín, Eliseo
21-Feb-2021Room temperature conductance switching in a molecular iron(iii) spin crossover junctionKaruppannan, Senthil Kumar; Martín Rodríguez, Alejandro; Ruiz Sabín, Eliseo; Harding, Phimphaka; Harding, David J.; Yu, Xiaojiang; Tadich, Anton; Cowie, Bruce; Qi, Dongchen; Nijhuis, Christian A.
15-Feb-2021A multifunctional Dysprosium-carboxylato 2D metallorganic frameworkGonzález, Jonay; Sevilla, Pablo; Gabarró Riera, Guillem; Jover Modrego, Jesús; Echeverría, Jorge; Fuertes, Sara; Arauzo, Ana; Bartolomé, Elena; Sañudo Zotes, Eva Carolina
30-Apr-2020Weak localization competes with the quantum oscillations in a natural electronic superlattice: the case of Na1.5(PO2)4(WO3)20Kolincio, K. K.; Pérez, O.; Canadell, Enric, 1950-; Alemany i Cahner, Pere; Duverger-Nédellec, E.; Minelli, A.; Bosak, A.; Pautrat, A.
19-Jan-2021Barnes Update Applied in the Gauss−Newton Method: An Improved Algorithm to Locate Bond Breaking PointsBofill i Villà, Josep M.; Valero Montero, Rosendo; Ribas Ariño, Jordi; Quapp, Wolfgang
22-Jun-2021Competition of quantum effects in H2/D2 sieving in narrow single-wall carbon nanotubesMondelo-Martell, Manel; Huarte Larrañaga, Fermín
7-May-2020Morphology of TiO2 nanoparticles as fingerprint for the transient absorption spectra: implications for photocatalysisMorales García, Ángel; Valero Montero, Rosendo; Illas i Riera, Francesc
6-Aug-2020Crystallization Induced Enhanced Emission in Two New Zn(II) and Cd(II) Supramolecular Coordination Complexes with the 1-(3,4-Dimethylphenyl)-5-Methyl-1H-1,2,3-Triazole-4-Carboxylate LigandNarea, Pilar; Cisterna, Jonathan; Cárdenas, Alejandro; Amo-Ochoa, Pilar; Zamora, Félix; Climent Biescas, Claudia; Alemany i Cahner, Pere; Conejeros Espíndola, Sergio; Llanos, Jaime; Brito, Iván