Rogério Custodio

9PUBLICATIONS
2CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsOptimisationIntegrable systems (classical and quantum)Theoretical quantum chemistryMathematical aspects of quantum and conformal field theory, quantum gravity and string theory
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (9)

|Feb 09, 2026
TD-DFT Evaluation of Electronic Spectra of Coumarin and Anthraquinone Dyes: Effects of Functionals, Basis Sets, and Solvation Conditions.

Guilherme Gustavo Silva Amorim, Paula Homem-de-Mello, Rogério Custodio

|Dec 12, 2024
A Preliminary Neural Network-Based Composite Method for Accurate Prediction of Enthalpies of Formation.

Gabriel César Pereira, Rogério Custodio

|Jun 09, 2023
Preliminary Assessment of the First-Order Density Matrix in Quantum Monte Carlo from Density Matrix Theory.

Wagner F D Angelotti, José R S Politi, Rogério Custodio

|Jan 14, 2022
Reply to the "Comment on 'On the Accuracy of the Direct Method to Calculate pKa from Electronic Structure Calculations'".

Felipe Ribeiro Dutra, Cleuton de Souza Silva, Rogério Custodio

|Jun 30, 2021
Assessment of a numeric variational method for the solution of confined multielectron atoms.

Guilherme de Souza Tavares de Morais, Rogério Custodio

|Mar 10, 2021
Systematic Convergence of the Numerical Taylor Series to the Best Standard and Its Potential Implication for the Development of Composite Methods.

Guilherme Luiz Chinini, Rogério Custodio

Pageof 2

Frequent Collaborators

1 joint publications

Wagner F D Angelotti

1 joint publications

Paula Homem-de-Mello