Solving the CH 4 − Riddle: The Fundamental Role of Spin to Explain Metastable Anionic Methane von Ramírez-Solís, Alejandro, Vigué, Jacques, Hinojosa, Guillermo, Saint-Martin, Humberto

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Ammonia Solvation vs Aqueous Solvation of Samarium Diiodide. A Theoretical and Experimental Approach to Understanding Bond Activation Upon Coordination to Sm(II) von Ramírez-Solís, Alejandro, Boekell, Nicholas G, León-Pimentel, César Iván, Saint-Martin, Humberto, Bartulovich, Caroline O, Flowers, Robert A

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Direct Coexistence Methods to Determine the Solubility of Salts in Water from Numerical Simulations. Test Case NaCl von Manzanilla-Granados, Héctor M, Saint-Martín, Humberto, Fuentes-Azcatl, Raúl, Alejandre, José

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Entropic Effects on the Aqueous Microsolvation of Protonated Glycine and Protonated β‑Alanine. Hybrid Density Functional Theory Born–Oppenheimer Molecular Dynamics Studies von Romero-Ramírez, Iván Eliezer, Ramírez-Solís, Alejandro, Saint-Martin Posada, Humberto

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Proton donor effects on the reactivity of SmI2. Experimental and theoretical studies on methanol solvation vs. aqueous solvation von Ramírez-Solís, Alejandro, Bartulovich, Caroline O, León-Pimentel, César Iván, Saint-Martin, Humberto, Boekell, Nicholas G, Flowers, Robert A

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A Theoretical Study of the Hydration of Methane, from the Aqueous Solution to the sI Hydrate-Liquid Water-Gas Coexistence von Luis, Daniel Porfirio, García-González, Alcione, Saint-Martin, Humberto

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A theoretical study of the confinement of methane in water clusters von Bravo-Pérez, Graciela, Saint-Martin, Humberto

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Dynamics and Structure of Ln(III)−Aqua Ions: A Comparative Molecular Dynamics Study Using ab Initio Based Flexible and Polarizable Model Potentials von Villa, Alessandra, Hess, Berk, Saint-Martin, Humberto

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Ion hydration in nanopores and the molecular basis of selectivity von Carrillo-Tripp, Mauricio, San-Román, María Luisa, Hernańdez-Cobos, Jorge, Saint-Martin, Humberto, Ortega-Blake, Iván

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Tracing source and mobility of arsenic and trace elements in a hydrosystem impacted by past mining activities (Morelos state, Mexico) von Barats, Aurélie, Renac, Christophe, Orani, Anna Maria, Durrieu, Gaël, Saint Martin, Humberto, Esteller, Maria Vicenta, Garrido Hoyos, Sofia Esperenza

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A Four-Site Molecular Model for Simulations of Liquid Methanol and Water–Methanol Mixtures: MeOH-4P von Martínez-Jiménez, Manuel, Saint-Martin, Humberto

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Proton donor effects on the reactivity of SmI2. Experimental and theoretical studies on methanol solvationvs. aqueous solvation von Ramirez-Solis, Alejandro, Bartulovich, Caroline O., Ivan Leon-Pimentel, Cesar, Saint-Martin, Humberto, Boekell, Nicholas G., Flowers, Robert A.

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Development of first-principles interaction model potentials. An application to the study of the bromide hydration von Ayala, Regla, Martı́nez, José M., Pappalardo, Rafael R., Saint-Martı́n, Humberto, Ortega-Blake, Ivan, Sánchez Marcos, Enrique

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Experimental and Theoretical Studies on the Aqueous Solvation and Reactivity of SmCl 2 and Comparison with SmBr 2 and SmI 2 von Ramírez-Solís, Alejandro, Bartulovich, Caroline O., León-Pimentel, César Iván, Saint-Martin, Humberto, Anderson, William R., Flowers, Robert A.

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Hydration of CH3HgOH and CH3HgCl compared to HgCl2, HgClOH, and Hg(OH)2: A DFT microsolvation cluster approach von Amaro-Estrada, Jorge I., Hernández-Cobos, Jorge, Saint-Martin, Humberto, Maron, Laurent, Ramírez-Solís, Alejandro

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Experimental and Theoretical Studies on the Aqueous Solvation and Reactivity of SmCl2 and Comparison with SmBr2 and SmI2 von Ramírez-Solís, Alejandro, Bartulovich, Caroline O, León-Pimentel, César Iván, Saint-Martin, Humberto, Anderson, William R

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A Molecular Dynamics Calculations of Hole Transfer Rates in DNA Strands von Volobuyev, Maksym, Saint-Martin, Humberto, Adamowicz, Ludwik

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Minimalist molecular model for nanopore selectivity von CARRILLO-TRIPP, Mauricio, SAINT-MARTIN, Humberto, ORTEGA-BLAKE, Ivan

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Following the path of experimental data from computational biophysics to nanotechnology von Saint-Martin, Humberto

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Fifty Years of Molecular Simulations at UAM and in Mexico von Nuñez-Rojas, Edgar, Pérez de la Luz, Alexander, Saint-Martín, Humberto, Alejandre, José

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