Diffusion and reaction pathways of water near fully hydrated TiO2 surfaces from ab initio molecular dynamics von Agosta, Lorenzo, Brandt, Erik G., Lyubartsev, Alexander P.

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Acid reducing leaching of cathodic powder from spent lithium ion batteries: Glucose oxidative pathways and particle area evolution von Pagnanelli, Francesca, Moscardini, Emanuela, Granata, Giuseppe, Cerbelli, Stefano, Agosta, Lorenzo, Fieramosca, Antonio, Toro, Luigi

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Water driven adsorption of amino acids on the (101) anatase TiO₂ surface: an ab initio study von Agosta, Lorenzo, Zollo, Giuseppe, Arcangeli, Caterina, Buonocore, Francesco, Gala, Fabrizio, Celino, Massimo

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Improved Sampling in Ab Initio Free Energy Calculations of Biomolecules at Solid–Liquid Interfaces: Tight-Binding Assessment of Charged Amino Acids on TiO2 Anatase (101) von Agosta, Lorenzo, Brandt, Erik G., Lyubartsev, Alexander

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From Chalcogen Bonding to S–π Interactions in Hybrid Perovskite Photovoltaics von Luo, Weifan, Kim, SunJu, Lempesis, Nikolaos, Merten, Lena, Kneschaurek, Ekaterina, Dankl, Mathias, Carnevali, Virginia, Agosta, Lorenzo, Slama, Vladislav, VanOrman, Zachary, Siczek, Miłosz, Bury, Wojciech, Gallant, Benjamin, Kubicki, Dominik J., Zalibera, Michal, Piveteau, Laura, Deconinck, Marielle, Guerrero‐León, L. Andrés, Frei, Aaron T., Gaina, Patricia A., Carteau, Eva, Zimmermann, Paul, Hinderhofer, Alexander, Schreiber, Frank, Moser, Jacques‐E., Vaynzof, Yana, Feldmann, Sascha, Seo, Ji‐Youn, Rothlisberger, Ursula, Milić, Jovana V.

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Thermodynamics of dissociated water motifs at oxide-bulk water interfaces: The TiO2 anatase (0 0 1) case von Zollo, Giuseppe, Hermansson, Kersti, Agosta, Lorenzo

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Cover Picture: Origin of the Hydrophobic Behaviour of Hydrophilic CeO 2 (Angew. Chem. Int. Ed. 35/2023) von Agosta, Lorenzo, Arismendi‐Arrieta, Daniel, Dzugutov, Mikhail, Hermansson, Kersti

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Supercooled liquid-like dynamics in water near a fully hydrated titania surface: Decoupling of rotational and translational diffusion von Agosta, Lorenzo, Dzugutov, Mikhail, Hermansson, Kersti

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Origin of the Hydrophobic Behaviour of Hydrophilic CeO2 von Agosta, Lorenzo, Arismendi‐Arrieta, Daniel, Dzugutov, Mikhail, Hermansson, Kersti

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Tautomeric mixture coordination enables efficient lead-free perovskite LEDs von Han, Dongyuan, Wang, Jie, Agosta, Lorenzo, Zang, Ziang, Zhao, Bin, Kong, Lingmei, Lu, Haizhou, Mosquera-Lois, Irea, Carnevali, Virginia, Dong, Jianchao, Zhou, Jianheng, Ji, Huiyu, Pfeifer, Lukas, Zakeeruddin, Shaik M., Yang, Yingguo, Wu, Bo, Rothlisberger, Ursula, Yang, Xuyong, Grätzel, Michael, Wang, Ning

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The entropic origin of the enhancement of liquid diffusion close to a neutral confining surface von Agosta, Lorenzo, Briels, Wim, Hermansson, Kersti, Dzugutov, Mikhail

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Adsorption of Glycine on TiO 2 in Water from On-the-fly Free-Energy Calculations and In Situ Electrochemical Impedance Spectroscopy von Agosta, Lorenzo, Fiore, Luca, Colozza, Noemi, Pérez-Ropero, Guillermo, Lyubartsev, Alexander, Arduini, Fabiana, Hermansson, Kersti

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Low-loss contacts on textured substrates for inverted perovskite solar cells von Park, So Min, Wei, Mingyang, Lempesis, Nikolaos, Yu, Wenjin, Hossain, Tareq, Agosta, Lorenzo, Carnevali, Virginia, Atapattu, Harindi R., Serles, Peter, Eickemeyer, Felix T., Shin, Heejong, Vafaie, Maral, Choi, Deokjae, Darabi, Kasra, Jung, Eui Dae, Yang, Yi, Kim, Da Bin, Zakeeruddin, Shaik M., Chen, Bin, Amassian, Aram, Filleter, Tobin, Kanatzidis, Mercouri G., Graham, Kenneth R., Xiao, Lixin, Rothlisberger, Ursula, Grätzel, Michael, Sargent, Edward H.

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Water Kinetics and Clustering on the (101) TiO2 Anatase Surface von Gala, Fabrizio, Agosta, L, Zollo, Giuseppe

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Multiparametric analysis by paper-assisted potentiometric sensors for diagnostic and monitoring of reinforced concrete structures von Colozza, Noemi, Tazzioli, Sara, Sassolini, Alessandro, Agosta, Lorenzo, di Monte, Maria Giuseppina, Hermansson, Kersti, Arduini, Fabiana

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Origin of the Hydrophobic Behaviour of Hydrophilic CeO 2 von Agosta, Lorenzo, Arismendi-Arrieta, Daniel, Dzugutov, Mikhail, Hermansson, Kersti

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Cover Picture: Origin of the Hydrophobic Behaviour of Hydrophilic CeO2 (Angew. Chem. Int. Ed. 35/2023) von Agosta, Lorenzo, Arismendi‐Arrieta, Daniel, Dzugutov, Mikhail, Hermansson, Kersti

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Vertical-Flow Paper Sensor for On-Site and Prompt Evaluation of Chloride Contamination in Concrete Structures von Colozza, Noemi, Tazzioli, Sara, Sassolini, Alessandro, Agosta, Lorenzo, di Monte, Maria Giuseppina, Hermansson, Kersti, Arduini, Fabiana

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Water on ceria{111}: Comparison between 23 experimental vibrational studies in the literature and new modeling von Röckert, Andreas, Kullgren, Jolla, Sethio, Daniel, Agosta, Lorenzo, Hermansson, Kersti

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Adsorption of Glycine on TiO2 in Water from On-the-fly Free-Energy Calculations and In Situ Electrochemical Impedance Spectroscopy von Agosta, Lorenzo, Fiore, Luca, Colozza, Noemi, Pérez-Ropero, Guillermo, Lyubartsev, Alexander, Arduini, Fabiana, Hermansson, Kersti

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