Modeling Tools and Techniques for Process R&D


Description:
An effective use of modeling in R&D would improve planning, analysis, evaluation, validation and progression of a program. This session focuses on development, optimization, scale-up and troubleshooting in Process R&D using various modeling tools and techniques, from both academia and industry. The tools and techniques include, but are not limited to, data modeling, stochastic modeling, mathematical/numerical modeling, first-principle modeling, process modeling, automation, etc.

Sponsor:
Process Research and Innovation


Chair:
Gaurav Arora
Lead Scientist
Sabic Americas, Inc.
Process Technology
Sugar Land, TX
Email: garora@sabic.com

Co-Chair:
Mohammad Shafiei
SR. Manager
Sabic Americas, Inc.
Process Technology
SABIC Technology Center
Sugar Land, TX
77478
Email: mshafiei@americas.sabic.com


Papers:
Using Novel Multiphase Simulation Techniques for Innovative Process Development – Case Studies in PO Processes
Sameer Vijay, Borealis Polyolefine GmbH
Composition Broadening in Polymerization Systems
Carlos Villa, The Dow Chemical Company; Ivan Konstantinov, The Dow Chemical Company; Pradeep Jain, Dow Chemical; Karjala Tom, Dow Chemical; Shrikant Dhodapkar, The Dow Chemical Company
Solid Suspension in Stirred Vessels: Comparison of a Fully Coupled CFD-DEM and an Eulerian Multiphase Approach
Thomas Eppinger, CD-adapco; Oleh Baran, CD-adapco New Hampshire; Ravindra Aglave, Siemens PLM Software
A Refined Non-Random Two-Liquid Segment Activity Coefficient Model for Solubility Modeling
Yifan Hao, Texas Tech University; M. R. Islam, Texas Tech University; Meng Wang, Texas Tech University; Chau-Chyun Chen, Texas Tech University
Tracking Down Organic Acids and Sulfides from Petroleum Fluids: An Application of Real Molecule-Based Crude Assay Characterization and Segment-Based PC-SAFT
Meng Wang, Texas Tech University; Chau-Chyun Chen, Texas Tech University
A Comprehensive Thermodynamic Model for the Lithium Chloride and Water Binary System Using the Electrolyte NRTL Model
Toni Kirkes, Texas Tech University; Chau-Chyun Chen, Texas Tech University
Thermodynamic Modeling of HCl-H2so4-H2o Ternary System with Electrolyte NRTL Model
Harnoor Kaur, Texas Tech University; Chau-Chyun Chen, Texas Tech University
Linear Dynamic Model Identification and Data Reconciliation Using Dynamic Iterative PCA (DIPCA)
Vipul Mann, Indian Institute of Technology Madras; Arun Tangirala, Indian Institute of Technology Madras; Shankar Narasimhan, Indian Institute of Technology
Input Design for Lti Systems with Multiple Time Scales
Vivek Shankar Pinnamaraju, IIT Madras; Arun Tangirala, Indian Institute of Technology Madras
Centrifugal Compressor Surge Exploration TESTS and Second Quadrant Characteristic Dynamic Modeling
Fabio Baldanzini Sr., GE Oil&Gas; Mirco Calosi Sr., GE Oil&Gas; Marco Pelella Sr., GE Oil&Gas
Calculation of Optical Properties of Molecular Dyes Using Time-Dependent Density Functional Theory (TD-DFT) and Development of Quantitative Structure-Property Relationships (QSPR)
Julibeth M. Martinez-De la Hoz, Dow chemical
See more of this Group/Topical: Process Development Division
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