Computer-aided multi-scale simulation of MOF-based membrane separation for CO₂ removal via integration of molecular and process simulation through machine learning

Keyphrases

• Activation Energy 33%
• Adsorption Isotherm 33%
• CO2 Removal 100%
• CO2-CH4 Separation 33%
• Computer-aided 100%
• Dramatic Effect 33%
• Finite Volume Method 33%
• Gas Mixture 33%
• High Productivity 33%
• High Reliability 33%
• Hollow Fiber Membrane 33%
• IRMOF-1 66%
• Isotherm 33%
• Machine Learning 100%
• Mean Squared Error 33%
• Membrane Performance 33%
• Membrane Separation 100%
• MOF Membrane 100%
• Molecular Simulation 100%
• Multiscale Simulation 100%
• Operating Condition Effects 33%
• Operating Conditions 66%
• Predictive Models 100%
• Process Performance 33%
• Process Simulation 100%
• R-square 33%
• Reliability Prediction 33%
• Selective Activation 33%
• Self-diffusivity 33%
• Tanks-in-series Model 33%

Chemical Engineering

• Adsorption Isotherm 50%
• Diffusion 50%
• Learning System 100%
• Membranes Separation 100%
• Methane 50%