147 citations · 304 across the 8 of their papers we have counts for
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physics.chem-ph2022★ 2 cited
Local intermolecular structure, hydrogen bonding and related dynamics in the liquid cis/trans N-methylformamide mixture: A density functional theory based Born-Oppenheimer molecular dynamics study
Ioannis Skarmoutsos, Ricardo L. Mancera, Stefano Mossa +1
The local intermolecular structure and related dynamics in the liquid cis-trans N-methylformamide mixture at ambient temperature and density conditions have been systematically stu…
cond-mat.soft2022★ 16 cited
Using Car-Parrinello simulations and microscopic order descriptors to reveal two locally favored structures with distinct molecular dipole moments and dynamics in ambient liquid water
Ioannis Skarmoutsos, Giancarlo Franzese, Elvira Guardia
Water is essential for life and technological applications, mainly for its unique thermodynamic and dynamic properties, often anomalous or counterintuitive. These anomalies result…