Rodrigo Neumann Barros Ferreira

7PUBLICATIONS
11CO-AUTHORS
Transport properties and non-equilibrium processesPyrometallurgyMetal organic frameworksChemical thermodynamics and energeticsComputational chemistry
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Publications (7)

|Jun 16, 2026
Molecular diffusion enhanced performance evaluation of metal-organic frameworks for CO2 capture.

|Nov 12, 2025
TBHubbard: tight-binding and extended Hubbard model dataset for metal-organic frameworks.

Pamela Costa Carvalho, Federico Zipoli, Alan C Duriez

|Aug 11, 2025
Mode-Selective Raman Imaging of Metal-Organic Frameworks Reveals Surface Heterogeneities of Single HKUST‑1 Crystals.

Matheus Esteves Ferreira, Mariana Del Grande, Felipe Lopes Oliveira

|Sep 18, 2024
pyMSER─An Open-Source Library for Automatic Equilibration Detection in Molecular Simulations.

Felipe L Oliveira, Binquan Luan, Pierre M Esteves

|Apr 20, 2023
CRAFTED: An exploratory database of simulated adsorption isotherms of metal-organic frameworks.

Felipe Lopes Oliveira, Conor Cleeton, Rodrigo Neumann Barros Ferreira

|Mar 08, 2023
Quantum Informed Machine-Learning Potentials for Molecular Dynamics Simulations of CO2's Chemisorption and Diffusion in Mg-MOF-74.

Bowen Zheng, Felipe Lopes Oliveira, Rodrigo Neumann Barros Ferreira

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Frequent Collaborators

3 joint publications

Binquan Luan

3 joint publications

Felipe Lopes Oliveira

1 joint publications

Michael Engel

1 joint publications

Grace X Gu