Improving Predictions of Gas Adsorption in Metal-Organic Frameworks with Coordinatively Unsaturated Metal Sites: Model Potentials, ab initio Parameterization and GCMC Simulations

Linjiang Chen, Carole Morrison, Tina Düren

Research output: Contribution to journalArticlepeer-review

Fingerprint

Dive into the research topics of 'Improving Predictions of Gas Adsorption in Metal-Organic Frameworks with Coordinatively Unsaturated Metal Sites: Model Potentials, ab initio Parameterization and GCMC Simulations'. Together they form a unique fingerprint.

Chemical Compounds

Engineering & Materials Science

Physics & Astronomy