Publications

5 results for Breanndan O'Conchuir

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
Conference paper
Effect of Partial Charges on the Data-Driven Analytics of CO2 Adsorption Metrics
- - Breanndan O'Conchuir
  - Binquan Luan
  - et al.
- 2022
- ACS Fall 2022
Short paper
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
Short paper
Prediction of CO2 Adsorption in Nano-Pores with Graph Neural Networks
- - GUOJING CONG
  - Anshul Gupta
  - et al.
- 2022
- AAAI 2022
Workshop paper
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
Short paper