Gonzalo Díaz Mirón

7PUBLICATIONS
39CO-AUTHORS
Chemical thermodynamics and energeticsPhotochemistryCatalysis and mechanisms of reactionsComputational chemistryNonlinear optics and spectroscopy
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Publications (7)

|Oct 23, 2026
Hydrogen Detachment in Diprotic Aromatics: O-H versus N-H Photodissociation in m-Aminophenol.

|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

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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