Daniel Mejía-Rodríguez

18PUBLICATIONS
79CO-AUTHORS
Metal cluster chemistryElectrochemical energy storage and conversionTheoretical quantum chemistryNonlinear optics and spectroscopyQuantum technologies
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Publications (18)

|Sep 03, 2026
Negative Ion Photoelectron Spectroscopy of Exotic Gaseous Iron-Cyanide Dianions [Fe(CN)n]2- (n = 4-6): Experiment and Many-Body Perturbation Theory.

|Apr 13, 2026
Thiol post-translational modifications modulate allosteric regulation of the OpcA-G6PDH complex through conformational gate control.

Hoshin Kim, Song Feng, Pavlo Bohutskyi

|Jan 06, 2026
Modeling the behavior of concentrated aqueous HNO3 using machine learning interatomic potentials.

Mohammadhasan Dinpajooh, Michael D Lacount, Scott E Muller

|Dec 15, 2025
Quantum Electrodynamics Coupled-Cluster at Scale: High-Performance Implementation for Complex Systems.

Nicholas P Bauman, Himadri Pathak, Marcus D Liebenthal

|Dec 15, 2025
A Meta-Generalized Gradient Approximation for the Cavity-Dependent Exchange-Correlation Interaction in Strongly Coupled Light-Matter Systems.

Daniel Mejia-Rodriguez, Niranjan Govind

|Nov 11, 2025
A Perspective on Quantum Computing Applications in Quantum Chemistry Using 25-100 Logical Qubits.

Yuri Alexeev, Victor S Batista, Nicholas Bauman

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Frequent Collaborators

10 joint publications

Niranjan Govind

6 joint publications

Edoardo Aprà

5 joint publications

Karol Kowalski

4 joint publications

Bo Peng