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Active Topological Glass Confined within a Spherical Cavity

Iurii Chubak , Stanard Mebwe Pachong , Kurt Kremer , Christos N Likos , Jan Smrek et al.
Macromolecules, 2022, 55 (3), pp.956 - 964. ⟨10.1021/acs.macromol.1c02471⟩
Journal articles hal-03576730v1
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MetalWalls: Simulating electrochemical interfaces between polarizable electrolytes and metallic electrodes

Alessandro Coretti , Camille Bacon , Roxanne Berthin , Alessandra Serva , Laura Scalfi et al.
Journal of Chemical Physics, 2022, 157 (18), pp.184801. ⟨10.1063/5.0101777⟩
Journal articles hal-03843736v1
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NMR relaxation rates of quadrupolar aqueous ions from classical molecular dynamics using force-field specific Sternheimer factors

Iurii Chubak , Laura Scalfi , Antoine Carof , Benjamin Rotenberg
Journal of Chemical Theory and Computation, 2021, 17 (10), pp.6006-6017. ⟨10.1021/acs.jctc.1c00690⟩
Journal articles hal-03366324v1
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Multiscale Approaches for Confined Ring Polymer Solutions

Iurii Chubak , Christos N Likos , Sergei A Egorov
Journal of Physical Chemistry B, 2021, ⟨10.1021/acs.jpcb.1c01953⟩
Journal articles hal-03217245v1