Orlando Carrillo-Bohórquez, Álvaro Valdés, and Rita Prosmiti. Unraveling the Origin of Symmetry Breaking in H2O@C60 Endofullerene Through Quantum Computations. ChemPhysChem 23, e202200034, (2022) http://dx.doi.org/10.1002/cphc.202200034

Eduardo Rodríguez, Carolina Neira, Álvaro Valdés. Equality without equity: The gender pay gap at the National University of Colombia. Latin American Economic Review 30 (1), 1-30 (2021) http://dx.doi.org/10.47872/laer.v30.35

Orlando Carrillo-Bohórquez, Álvaro Valdés, and Rita Prosmiti. Encapsulation of a Water Molecule inside C60 Fullerene: The Impact of Confinement on Quantum Features. J. Chem. Theory Comput. 2021, 17, 5839−5848 http://dx.doi.org/10.1021/acs.jctc.1c00662

Adriana Cabrera-Ramírez, Daniel J. Arismendi-Arrieta, Álvaro Valdés,and Rita Prosmiti. Exploring CO2@sI Clathrate Hydrates as CO2 Storage Agents by Computational Density Functional Approaches. ChemPhysChem, 22, 359 –369 (2021) http://dx.doi.org/10.1002/cphc.202001035

Adriana Cabrera-Ramírez, Daniel J. Arismendi-Arrieta, Álvaro Valdés,and Rita Prosmiti. Structural Stability of the CO2@sI Hydrate: a Bottom-Up Quantum Chemistry Approach on the Guest-Cage and Inter-Cage Interactions. ChemPhysChem 21, 2618– 2628 (2020) http://dx.doi.org/10.1002/cphc.202000753

Álvaro Valdés, Orlando Carrillo-Bohórquez y Rita Prosmiti. Quantum effects of the stability of the He5I2 van der Waals conformers. Journal of Computational Chemistry. 40, 2200 (2019) http://dx.doi.org/10.1002/jcc.25870

Rita Prosmiti and Álvaro Valdés. The smallest proton-bound dimer H5+: theoretical progress. Philosophical Transactions ot the Royal Sociaty A, 377 (2019) http://dx.doi.org/10.1098/rsta.2018.0396

Daniel J. Arismendi-Arrieta, Álvaro Valdés and Rita Prosmiti A Systematic Protocol for Benchmarking Guest–Host Interactions by First‐Principles Computations: Capturing CO2 in Clathrate Hydrates Chem. Eur. J. 24 (2018) http://dx.doi.org/10.1002/chem.201800497