Publications

75 results for Rodrigo Neumann Barros Ferreira

Ab-initio Raman simulations of metal-organic-frameworks
- - Pamela Costa Carvalho
  - Felipe Lopes Oliveira
  - et al.
- 2024
- Enbraer 2024
Exploring qubit-ADAPT-VQE for materials discovery in direct air capture
- 2024
- Apl Quantum
Surface reaction calculations with quantum computers for battery materials
- 2024
- ACS Fall 2024
Selecting Covalent Organic Frameworks for Gas Capture using micro-Raman Spectroscopy
- - Geisa Lima
  - Matheus Esteves Ferreira
  - et al.
- 2024
- ACS Fall 2024
In-situ characterization of metal-organic frameworks: A combined DFT and micro-Raman spectroscopy approach
- - Matheus Esteves Ferreira
  - Geisa Lima
  - et al.
- 2024
- ACS Fall 2024
Dataset of Reticular Materials' Syntheses Automatically Created from PDFs by using LLMs
- 2024
- ACS Fall 2024
AI-Assisted Raman Spectral Peak Label Assignment
- 2024
- ACS Fall 2024
Pore-scale flow simulator for studying carbon dioxide capillary trapping under varying wettability scenarios
- - Jaione Tirapu Azpiroz
  - Rodrigo Neumann Barros Ferreira
  - et al.
- 2024
- LAMIC 2024
Simulating CO₂ diffusivity in rigid and flexible Mg-MOF-74 with machine-learning force fields
- - Bowen Zheng
  - Grace Gu
  - et al.
- 2024
- APL Mach. Learn.
Machine-Learning Potentials for Simulating CO₂ Chemisorption
- - Binquan Luan
  - Carine Dos Santos
  - et al.
- 2024
- APS March Meeting 2024