Annabella Selloni

38PUBLICATIONS
73CO-AUTHORS
Reaction kinetics and dynamicsProcess control and simulationColloid and surface chemistryTransport properties and non-equilibrium processesEcohydrology
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Publications (38)

|Sep 03, 2026
Ab Initio Modeling of Aqueous Methanol Mixtures at DFT-SCAN Level Using Machine Learning Interatomic Potentials.

|Jul 29, 2026
Understanding Adsorption and Reactions at Aqueous Oxide Interfaces with Neural Network Potential Molecular Dynamics.

|Jun 22, 2026
Adsorption and Sulfur-Selective Photooxidation of Cysteine on Anatase TiO2(101).

|Jun 01, 2026
Ion Distribution and Cation Exchange at Mica-Electrolyte Interfaces Probed with Deep Potential Molecular Dynamics.

|Apr 23, 2026
Insights into the Reactivity of Brookite TiO2 Nanorods in Liquid Water from Ab Initio Molecular Dynamics Simulations.

|Mar 16, 2026
Atomic-Scale Mapping of Interfacial Water on Oxide Surfaces via Proton-Resolved NMR and Ab Initio Simulations.

Lorenzo Agosta, Ken Conover, Przemyslaw Rzepka

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Frequent Collaborators

6 joint publications

Bo Wen

6 joint publications

Marcos F Calegari Andrade

5 joint publications

Roberto Car

3 joint publications

Nan Yao