Fabio Falcioni

6PUBLICATIONS
90CO-AUTHORS
Computational chemistryAcceleratorsTheoretical quantum chemistryRadiation and matter
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (6)

|Nov 13, 2025
A foundation model for atomistic materials chemistry.

Ilyes Batatia, Philipp Benner, Yuan Chiang

|May 09, 2024
Arginine Kinase Activates Arginine for Phosphorylation by Pyramidalization and Polarization.

Fabio Falcioni, Robert W Molt, Yi Jin

|Mar 13, 2024
Probing Non-Covalent Interactions through Molecular Balances: A REG-IQA Study.

Fabio Falcioni, Sophie Bennett, Pallas Stroer-Jarvis

|Oct 02, 2023
Interacting Quantum Atoms and Multipolar Electrostatic Study of XH···π Interactions.

Lena Triestram, Fabio Falcioni, Paul L A Popelier

|Jul 10, 2023
How to Compute Atomistic Insight in DFT Clusters: The REG-IQA Approach.

Fabio Falcioni, Paul L A Popelier

|Apr 04, 2023
A combined BET and IQA-REG study of the activation energy of non-polar zw-type [3+2] cycloaddition reactions.

Mar Ríos-Gutiérrez, Fabio Falcioni, Luis R Domingo

Pageof 1