Chemometric study of liquid water simulations. I. The parameters of the TIP4P model potential. - Marcelo Zaldini Hernandes; João Bosco P. Da Silva; Ricardo L. Longo (J. Comput. Chem., 2003)

PICVib: An accurate, fast, and simple procedure to investigate selected vibrational modes at high theoretical levels. - Marcus V. P. dos Santos; Eduardo C. Aguiar; João Bosco P. Da Silva; Ricardo L. Longo (J. Comput. Chem., 2013)

Revisiting the concept of the (a)synchronicity of diels-alder reactions based on the dynamics of quasiclassical trajectories. - Miguel Angelo Fonseca de Souza; Elizete Ventura; Silmar Andrade do Monte; José M. Riveros; Ricardo L. Longo (J. Comput. Chem., 2016)

Simulation of the Adsorption and Release of Large Drugs by ZIF-8. - Yaicel G. Proenza; Ricardo L. Longo (J. Chem. Inf. Model., 2020)

Concentration Scales and Solvation Thermodynamics: Some Theoretical and Experimental Observations Regarding Spontaneity and the Partition Ratio. - Diego J. Raposo da Silva; Jéssica I. R. de Souza; Ricardo L. Longo (Entropy, 2024)

Assessment of DFT Functionals for Structural Determination of Lanthanide(III) Complexes Using Ligand Field Splitting. - Lucca Blois; Renaldo T. Moura Jr.; Ricardo L. Longo; Oscar L. Malta; Hermi F. Brito; Albano N. Carneiro Neto (J. Comput. Chem., 2025)