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Accueil > Productions scientifiques > Publications > 2018 > Equipe Electrochimie et Liquides Ioniques

Equipe Electrochimie et Liquides Ioniques

par Mathieu Salanne - 3 décembre 2017

- Impact of Anion Vacancies on the Local and Electronic Structures of Iron-Based Oxyfluoride Electrodes
M. Burbano, M. Duttine, B.J. Morgan, O.J. Borkiewicz, K.W. Chapman, A. Wattiaux, A. Demourgues, H. Groult, M. Salanne, Damien Dambournet, J. Phys. Chem. Lett., in press (2018)

- A Molecular Density Functional Theory Approach to Electron Transfer Reactions
G. Jeanmairet, B. Rotenberg, M. Levesque, D. Borgis, M. Salanne, Chem. Sci., in press (2018)

- Performance of Microporous Carbon Electrodes for Supercapacitors : Comparing Graphene with Disordered Materials
T. Méndez-Morales, N. Ganfoud, Z. Li, M. Haefele, B. Rotenberg, M. Salanne, Energy Storage Mater., in press (2018)

- The Fate of Water at the Electrochemical Interfaces : Electrochemical Behavior of Free Water vs. Coordinating Water
N.Dubouis, A. Serva, E. Salager, M. Deschamps, M. Salanne, A. Grimaud, J. Phys. Chem. Lett. 9, 6683 (2018)

- Anionic Structure in Molten Cryolite–Alumina Systems
K. Machado, D. Zanghi, M. Salanne, V. Stabrowski, C. Bessada, J. Phys. Chem. C 122, 21807 (2018)

- La chimie des défauts, un outil pour le stockage de l’énergie
D. Dambournet, L’actualité Chimique 434, 63 (2018)

- Synthesis of oxy-hydroxyfluorinated anatase nanoparticles grown on carbon nanotubes
W. Li, E. Raymundo-Piñero, O.J. Borkiewicz, H. Groult, D.Dambournet, J. Fluor. Chem. 215, 32 (2018)

- The electrochemical storage mechanism in oxy-hydroxyfluorinated anatase for sodium-ion batteries
W. Li, M. Fukunishi, B.J. Morgan, O.J. Borkiewicz, V. Pralong, A. Maignan, H. Groult, S. Komaba, D. Dambournet, Inorg. Chem. Front. 5, 1100 (2018)

- Decomposition of CoF3 during battery electrode processing
W. Li, H. Groult, O.J. Borkiewicz, D. Dambournet, J. Fluor. Chem. 205, 43 (2018)

- Lithium Intercalation in Anatase Titanium Vacancies and the Role of Local Anionic Environment
J. Ma, W. Li, B.J. Morgan, J. Światowska, R. Baddour-Hadjean, M. Body, C. Legein, O.J. Borkiewicz, S. Leclerc, H. Groult, F. Lantelme, C. Laberty-Robert, D. Dambournet, Chem. Mater. 30, 3078 (2018)

- Origin of the High Capacity Manganese-Based Oxyfluoride Electrodes for Rechargeable Batteries
L. Zhang, D. Dambournet, A. Iadecola, D. Batuk, O.J. Borkiewicz, K.M. Wiaderek, E. Salager, M. Shao, G. Chen, J.-M. Tarascon, Chem. Mater. 30, 5362 (2018)

- Controlled hydroxy-fluorination reaction of anatase to promote Mg2+ mobility in rechargeable magnesium batteries
J. Ma, T. Koketsu, B.J. Morgan, C. Legein, M. Body, P. Strasser, D. Dambournet, Chem. Commun. 54, 10080 (2018)

- Atomic Structure of 2 nm Size Metallic Cobalt Prepared by Electrochemical Conversion : An in Situ Pair Distribution Function Study
W. Li, O.J. Borkiewicz, M. Saubanère, M.-L. Doublet, D. Flahaut , P.J. Chupas, K.W. Chapman, D. Dambournet, J. Phys. Chem. C 122, 23861 (2018)

- Ion-ion correlations across and between electrified graphene layers
T. Mendez-Morales, M. Burbano, M. Haefele, B. Rotenberg, M. Salanne, J. Chem. Phys. 148, 193812 (2018)

- Multiscale nuclear magnetic relaxation dispersion of complex liquids in bulk and confinement
J.-P. Korb, Progr. Nucl. Magn. Reson. Spectrosc. 104, 12–55 (2018)

- Blue Energy and Desalination with Nanoporous Carbon Electrodes : Capacitance from Molecular Simulations to Continuous Models
M. Simoncelli, N. Ganfoud, A. Sene, M. Haefele, B. Daffos, P.-L. Taberna, M. Salanne, P. Simon, B. Rotenberg, Phys. Rev. X 8, 021024 (2018)

- Classical Polarizable Force Field to Study Hydrated Hectorite : Optimization on DFT Calculations and Validation against XRD Data
R. Hande, V. Ramothe, S. Tesson, B. Dazas, E. Ferrage,
B. Lanson, M. Salanne, B. Rotenberg, V. Marry, Mineral, 8, 205 (2018)

- Materials for supercapacitors : When Li-ion battery power is not enough
Z. Lin, E. Goikolea, A. Balducci, K. Naoi, P.-L. Taberna, M. Salanne, G. Yushin, P. Simon, Materials Today, 21, 419-436 (2018)

- Computer simulation studies of nanoporous carbon-based electrochemical capacitors
Z. Li, T. Mendez-Morales, M. Salanne, Curr. Opin. Electrochem., 9, 81 (2018)

- Classical Polarizable Force Field To Study Hydrated Charged Clays and

S. Tesson, W. Louisfrema, M. Salanne, A. Boutin, E. Ferrage, B. Rotenberg, V. Marry, J. Phys. Chem. C, 122, 24690 (2018).

- Insights into Li+, Na+ and K+ Intercalation in Lepidocrocite-type Layered TiO2 Structures
K. G. Reeves, J. Ma, M. Fukunishi, M. Salanne, S. Komaba, D. Dambournet, ACS Appl. Energy Mater., 1, 2078 (2018)

- On the determination of ion transport numbers in molten salts using molecular dynamics
A. Gheribi, K. Machado, D. Zanghi, C. Bessada, M. Salanne, P. Chartrand, Electrochim. Acta, 274, 266 (2018)

- Structural study of Na2O-B2O3-SiO2-La2O3 glasses from molecular simulations using a polarizable force field
F. Pacaud, M. Salanne, T. Charpentier, L. Cormier, J.-M. Delaye, J. Non-Cryst. Solids, 499, 371 (2018)

- Capacitive Performance of Water-in-Salt Electrolytes in Supercapacitors : A Simulation Study
Z. Li, G. Jeanmairet, T. Mendez-Morales, B. Rotenberg, M. Salanne, J. Phys. Chem. C, 112, 23917 (2018)