2 papers
cond-mat.mtrl-sci2025
Singularly isostatic and geometrically unstable rigidity of metal-organic frameworks
Christopher M. Owen, Michael J. Lawler
Metal-organic frameworks (MOFs) combine high porosity with structural fragility, raising important questions about their mechanical stability. We develop a rigidity-based framework…
cs.LG2020
Graph Neural Network for Metal Organic Framework Potential Energy Approximation
Shehtab Zaman, Christopher Owen, Kenneth Chiu +1
Metal-organic frameworks (MOFs) are nanoporous compounds composed of metal ions and organic linkers. MOFs play an important role in industrial applications such as gas separation,…