• Skip to primary navigation
  • Skip to main content
  • Home
  • People
    • Professor
    • Postdoctoral Researcher
    • PhD Students
    • MS Students
    • Undergraduate Students
    • Visiting Scholar
    • Alumni
  • Research
    • Multiscale Modeling
      • Accelerated Heterogeneous Catalysis
      • Crystallization
      • Microwave Reactor Modeling
      • Paper Manufacturing
      • Lignocellulosic Biomass Fractionation
    • Hybrid Modeling
      • Hybrid Modeling of Chemical Processes
      • Application of Hybrid Modeling to Fermentation Processes
    • Data Science & Machine Learning
      • Data-driven Adaptive Modeling
      • Control Beyond the Training Domains
      • Battery Modeling and Monitoring
      • Fault Prognosis using Data-driven Adaptive Models
      • Machine Learning-Enhanced Crystallization
      • Model Reduction
    • Drug Discovery
      • Transformer-Driven ADMET Screening for Efficient Drug Evaluation
      • Latent Space Optimization for Molecular Design
      • Hybrid PBPK Modeling with Transformer-Based Pharmacokinetic Predictions
    • Molecular Dynamics Modeling
      • DFT-kMC-LSTM Energy Materials
      • Cellular Biochemical Reaction Pathways
      • Supramolecular Assemblies
    • Hydraulic Fracturing
      • Hydraulic Fracturing for Enhanced Productivity
      • Wastewater and Shale Gas
  • Publications
  • Presentations
  • Recent News
  • Location
  • Gallery

Kwon Research Group

Texas A&M University College of Engineering

Multiscale Modeling and Control of Fiber Morphology in Paper Manufacturing

In pulping processes, wood chip properties extensively change as a result of delignification. Specifically, cellulose fiber morphology in the wood chip, such as fiber length and cell wall thickness (CWT), drastically changes and affects end-use paper product quality and recyclability. However, the evolution of this important microscopic paper property is not able to be described by existing mathematical models as they only focus on macroscopic properties such as the concentration profiles of components and the temperature profiles of the cooking liquor and wood chip.
Motivated by this limitation, we developed a novel multiscale model by combining the mass continuity and thermal energy balance equations adopted from a modified “extended Purdue model” with a kinetic Monte Carlo algorithm to describe the microscopic events such as the evolution of CWT and Kappa number (i.e., residual lignin content in the wood pulp); otherwise, these microscopic properties of wood chips are not accessible by existing measurement techniques. To reduce the model complexity, a data-driven reduced-order model is developed, which is then used for designing a model-based feedback controller to regulate the microscopic properties of wood chips, which ultimately determine the paper properties (e.g., smoothness and stiffness) and recyclability.

Literature:

H. Choi and J. S. Kwon, “Modeling and control of cell wall thickness in batch delignification”, Comp. & Chem. Eng., 2019, 128, 512-523. 

H. Choi and J. S. Kwon, “Multiscale modeling and control of Kappa number and porosity in a batch pulp digester”,  AIChE J. 2019, 65(6), e16589.

 

© 2016–2025 Kwon Research Group Log in

Texas A&M Engineering Experiment Station Logo
  • State of Texas
  • Open Records
  • Risk, Fraud & Misconduct Hotline
  • Statewide Search
  • Site Links & Policies
  • Accommodations
  • Environmental Health, Safety & Security
  • Employment