[22] M. Barborini, J. Charry, M. Ditte, A. Leventis, G. Kafanas, A. Tkatchenko. "QMeCha: quantum Monte Carlo package for fermions in embedding environments" arxiv (2025) [Link]

[21] L. Martins, M. Bergami, J. Charry, A. Reyes, K. Coutinho, M. T. do N. Varella. "Positronium Atoms Solvated in Liquid Alcohols: A Multicomponent Quantum Mechanics/Molecular Mechanics Approach? " J. Phys. Chem. B. (2025) [Link]

[20]  R. Porras-Roldan, J. Charry, F. Moncada, R. Flores-Moreno,  M. Varella, A. Reyes.  "Watch out electrons!: Positron Binding Redefines Chemical Bonding in Be2" Chem. Sci. (2025) [Link]

[19] J. Charry, M. Barborini, A. Tkatchenko. "Unraveling chemical bonding mechanisms through dipole moment variations under external electric fields" Phys. Chem. Chem. Phys. 27, 23044, (2025) [Link]

[18] M. Puleva, L. Medrano-Sandonas,  B. Lőrincz , J. Charry, D. M. Rogers, P. R. Nagy, A. Tkatchenko. "Extending quantum-mechanical benchmark accuracy to biological ligand-pocket interactions" Nat. Comm, 16, 8583, (2025) [Link]

[17] M. Bergami, J. Charry, A. Reyes, K. Coutinho, M. T. do N. Varella. "Does Positron Attachment Take Place in Water Solution? " J. Phys. Chem. B. 128, 41, 10178–10188, (2024) [Link]

[16] D. Archila, F. Moncada, J. Charry, M. Varella, R. Flores-Moreno, F. J. Torres, A. Reyes, "Two-positron-bonded dihalides: Ps2XY (X,Y=F,Cl,Br)" Chem. Eur. J. e202402618, (2024) [Link]

[15] J. Charry, A. Tkatchenko, “van der Waals Radii of Free and Bonded Atoms from Hydrogen (Z = 1) to Oganesson (Z = 118)  J. Chem. Theory Comput. 20, 7469-7478, (2024) [Link]

[14] R. Porras-Roldan, F. Moncada, J. Charry, M. Varella, R. Flores-Moreno, A. Reyes. "Electron superhalogens as positronium superhalogens" Phys. Chem. Chem. Phys. 26, 18881-18891, (2024) [Link]

[13] J. Charry,  F. Moncada,  M. Barborini,  L. Pedraza-González,  M. T. do N. Varella,  A. Tkatchenko, A. Reyes. "The three-center two-positron bond"  Chem. Sci. 13, 13795 (2022). [Link]

[12] M. Bergami, A. L. D. Santana, J. Charry, A. Reyes, K. Coutinho, M. T. do N. Varella. "Multicomponent Quantum Mechanics/Molecular Mechanics Study of Hydrated Positronium" J. Phys. Chem. B 126, 14, 2699–2714, (2022) [Link]

[11] P. Szabó, S. Góger, J. Charry M. R. Karimpour, D. V. Fedorov,  A. Tkatchenko, "Four-Dimensional Scaling of Dipole Polarizability in Quantum Systems"  Phys. Rev. Lett. 128, 070602, (2022) [Link]

[10] J. Charry, M. Barborini, A. Tkatchenko.  "Correlated Wave Functions for Electron–Positron Interactions in Atoms and Molecules" J. Chem. Theory Comput. 18, 4, 2267–2280, (2022). [Link]

[8] A. Reyes, F. Moncada J. Charry. "The Any Particle Molecular Orbital approach: a short review of the theory and applications". Int. J. Quantum Chem. 119, e25705, (2019). [Link]

[7] J. Charry. M. T. do N. Varella, A. Reyes. "Binding matter with antimatter: the covalent positron bond". Angew. Chem. Int. Ed. 57 (29), 8859-8864, (2018). [Link] 

[6] L. Pedraza-González, J. Charry,  W. Quintero, J. Alí-Torres, A. Reyes. "Fast and accurate prediction of proton affinities: revisiting the extended Koopmans' theorem for protons". Phys. Chem. Chem. Phys. 19, 25324-25333, (2017). [Link] 

[5] J. Charry, L. Pedraza, A. Reyes. "On the physical interpretation of the nuclear molecular orbital energy". J Chem Phys. 146 (21), 214103, (2017). [Link]

[4] J. Romero, J. Charry, R. Flores-Moreno, M. T. do N. Varella and A. Reyes. "Calculation of positron binding energies using the generalized any particle propagator theory". J. Chem. Phys. 141, 114103 (2014). [Link]

[3]  J. A. Charry, J. Romero, M. T. do N. Varella and A. Reyes. "Calculation of positron binding energies of amino acids with the any-particle molecular-orbital approach". Phys. Rev. A. 89, 052709 (2014). [Link]

[2] J. Romero, J. A. Charry, H. Nakai and A. Reyes. "Improving quasiparticle second order electron propagator calculations with the spin-component-scaled technique". Chem. Phys. Lett. 591, 82 (2014). [Link]

[1] R. Flores-Moreno, E. F. Posada, F. Moncada, J. Romero, J. Charry, M. Díaz-Tinoco, S. A. Gonzalez, N. F. Aguirre and A. Reyes. "LOWDIN: The Any Particle Molecular Orbital Code". Int. J. Quantum Chem. 114, 50 (2013). [Link]