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20152021
most citedLithium Ion Solvation and Diffusion in Bulk Organic Electrolytes from First Principles and Classical Reactive Molecular Dynamics

210 citations · 212 across the 4 of their papers we have counts for

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physics.comp-ph2018

Hydrogenation and defect formation control the strength and ductility of MoS2 nanosheets: Reactive molecular dynamics simulation

Mostafa Hasanian, Bohayra Mortazavi, Alireza Ostadhossein +2

Two-dimensional (2D) molybdenum disulfide (MoS2) has attracted significant attention because of its outstanding properties, suitable for application in several critical technologie…