Gonzalo Díaz Mirón
6PUBLICATIONS
38CO-AUTHORS
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Publications (6)
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|Mar 11, 2026
Simulating the Photochemical Birth of the Hydrated Electron in Liquid Water.Gonzalo Díaz Mirón, Cesare Malosso, Solana Di Pino
|Nov 14, 2025
Deconstructing the origins of interfacial catalysis: Why electric fields are inseparable from solvation.Solana Di Pino, Debarshi Banerjee, Marta Monti
|Jun 06, 2025
Recent Developments in DFTB+, a Software Package for Efficient Atomistic Quantum Mechanical Simulations.B Hourahine, M Berdakin, J A Bich
|May 01, 2025
Data-Driven Discovery of the Origins of UV Absorption in the Alpha-3C Protein.Germaine Neza Hozana, Gonzalo Díaz Mirón, Ali Hassanali
|Nov 20, 2024
Non-adiabatic Couplings in Surface Hopping with Tight Binding Density Functional Theory: The Case of Molecular Motors.Gonzalo Díaz Mirón, Carlos R Lien-Medrano, Debarshi Banerjee
|Apr 18, 2024
Exploring the Mechanisms behind Non-aromatic Fluorescence with the Density Functional Tight Binding Method.Gonzalo Díaz Mirón, Carlos R Lien-Medrano, Debarshi Banerjee
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Frequent Collaborators
5 joint publications
Ali Hassanali
3 joint publications
Carlos R Lien-Medrano
2 joint publications
Solana Di Pino
2 joint publications
Bálint Aradi
2 joint publications
Thomas A Niehaus
1 joint publications
M Berdakin
1 joint publications
J A Bich
1 joint publications
C Camacho
1 joint publications
Q Cui
1 joint publications
M Elstner
