263 citations · 263 across the 3 of their papers we have counts for
3 papers
Pressure-Temperature Phase Diagram and -Transition in Liquid Sulfur
Sonia Salomoni, Frédéric Datchi, A. Marco Saitta +1
Using molecular dynamics simulations driven by a machine-learned interatomic potential, we investigate at low to intermediate pressures the -transition of sulfur, a temperature-…
Interfacial Electric Fields in Water Nanodroplets are Weakly Dependent on Curvature and pH
Gabriele Amante, Fortunata Panzera, Gabriele Centi +4
The origin of enhanced reactivity in aqueous microdroplets remains debated, with interfacial electric fields (IEFs) often invoked as catalytic drivers. Here, we provide a quantum-m…
Ab initio molecular dynamics study of dissociation of water under an electric field
A. Marco Saitta, Franz Saija, Paolo V. Giaquinta
The behavior of liquid water under an electric field is a crucial phenomenon in science and engineering. However, its detailed description at a microscopic level is difficult to ac…