Tonia Maracheril

Publications

• MDLab: AI frameworks for Carbon Capture and Battery Materials

  • • Bruce Elmegreen
    • Hendrik Hamann
    • et al.
  • 2025
  • Frontiers in Environmental Science

• Cloud-Based, High-Throughput, End-To-End Computational Screening of Solid Sorbent Materials for Carbon Capture

  • • Rodrigo Neumann Barros Ferreira
    • Breanndan O'Conchuir
    • et al.
  • 2022
  • GHGT 2022

• The role of partial charges in data-driven analytics of gas adsorption simulations

  • • Binquan Luan
    • Rodrigo Neumann Barros Ferreira
    • et al.
  • 2022
  • APS March Meeting 2022

• Automated AI-driven screening of nanoporous materials for enhanced carbon dioxide adsorption

  • • Breanndan O'Conchuir
    • Rodrigo Neumann Barros Ferreira
    • et al.
  • 2021
  • MRS Fall Meeting 2021