31st European Symposium on Computer Aided Process Engineering

Name: 31st European Symposium on Computer Aided Process Engineering | ESCAPE-31
Brand: Elsevier
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ESCAPE-31

Metin Türkay Rafiqul Gani(Editor)

Elsevier (Publisher)

Published on 22. July 2021

2140 pages

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9780323885133v1_WEB
Front Cover
31ST EUROPEAN SYMPOSIUM ON COMPUTER AIDED PROCESS ENGINEERING: Volume 1
Copyright
Contents
Preface
Theme Coordinators
Explanatory and Predictive Analysis of Naphtha Splitter Products
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusions
References
Multi-objective optimization of the supply chain for the production of biofuels and high value-added products in Mexico: importance of the water footprint
Abstract
1. Introduction
2. Case Study
3. Mathematical Model
4. Results
5. Conclusions
References
Synthesis of Combined Heat and Mass Exchange Networks Via a Trust Region Filter Optimisation Algorithm Including Detailed Unit Designs
Abstract
1. Introduction
2. Modelling framework
4. Conclusions
References
Computer-Aided Refrigerant Design: New Developments
Abstract
1. Introduction
2. Methods and tools for refrigerant selection and design
3. Application Examples
4. Conclusions
References
Comparative assessment of black liquor upgraded gasification in integrated kraft pulp, methanol and dimethyl ether production plants
Abstract
1. Introduction
2. Methods
3. Results and Discussion
4. Conclusions
References
Sustainable Process Design and Synthesis for HDPE Recycling
Abstract
1. Introduction
2. Superstructure Description of Waste HDPE Recycling
3. LCA and TEA Methodology
4. Model Formulation
5. Results and Discussion
6. Conclusion
References
A Novel Process Design for Waste Respirator Processing
Abstract
1. Introduction
2. Process Description for the Waste Respirator Processing System
3. LCA and TEA Methodology
4. Results and Discussion
5. Conclusion
References
Design and optimization of a shell-and-tube heat exchanger using the univariate marginal distribution algorithm
Abstract
1. Introduction
2. Shell-and-tube heat exchanger models
3. Univariate Marginal Distribution Algorithm
4. STHE optimization
5. Results
6. Conclusion
References
Synthesis of Microgels with Minimal Final Concentration of Initiator
Abstract
1. Introduction
2. Model of the microgel synthesis including oxygen inhibition
3. Dynamic optimization
4. Results and discussion
5. Conclusions
References
Novel Dual Reactive Distillation Process for Eco-efficient Lactic Acid Recovery and Purification from Fermentation Broth
Abstract
1. Introduction
2. Problem statement
3. Conceptual design approach
4. Results and discussion
5. Conclusions
Acknowledgments
References
Exergy Analysis of Vacuum Distillation Unit
Abstract
1. Introduction
2. Exergy Analysis
3. Case Study
4. Machine Learning Model
5. Results and Discussion
6. Conclusions
References
Computer-Aided Solvent Design Integrated with a Machine Learning-based Atom Contribution Method
Abstract
1. Introduction
2. MLAC-CAMD Framework for Solvent Design
3. Case Study
4. Conclusions
Acknowledgement
References
A versatile modelling system for integrated chemical product design problems
Abstract
1. Introduction
2. Versatile Modeling Framework
3. Multipurpose Tool for Product design
4. Case study
5. Conclusions
Acknowledgement
References
An integrated system of multi effect distillation and wind power system - Evaluation of total energy saving
Abstract
1 Introduction
2 Hybrid seawater desalination system of wind turbine and MED
3 Modelling of MED system
4 Simulation of MED system
5 Modelling of wind turbine energy
6 Evaluation of wind turbine and MED systems at various wind speeds
7 Conclusions
References
Modelling and Performance evaluation of the air heated and water heated Humidification-Dehumidification desalination process using solar thermal energy
Abstract
1. Introduction
2. Description of the HDH desalination models
3. Results and Discussion
4. Conclusions
References
Enhancement of energy saving of reverse osmosis system of Arab Potash Company via a wind energy system
Abstract
1 Introduction
2 Description of RO desalination plant powered by wind turbine system
3 Modelling of RO system of APC
4 Modelling of wind turbine system
5 Evaluation of a hybrid system of RO and wind turbine
5 Conclusions
References
Multi-objective optimization for the incorporation of safety and reliability considerations in process design
Abstract
1. Introduction
2. Problem Statement
3. Model formulation for reliability and safety
4. Case study
5. Results
6. Conclusions
References
Integrating Reliability and Uncertainty in Process Synthesis
Abstract
1. Introduction
2. General model formulation
3. Solution Method
4. Industrial Case Study
5. Solution Results
6. Conclusions
References
Optimization of Graded Bed Reactors for Syngas to Olefin (STO) Processes
Abstract
1. Motivation and Background Information
2. Reactor Modeling
3. Optimization Formulation and Solution Strategy
4. Results
5. Conclusions
References
Gas Lift Optimization for Optimum Oil Production from a Well Platform
Abstract
1. Introduction
2. Problem Statement
3. Methodology
4. Conclusion
Acknowledgement
Annexure A
Reference:
Techno-economic evaluation of sorption enhanced steam gasification of PKS system for syngas using CaO for CO2 capture
Abstract
1. Introduction
2. Methodology and Process Description
3. Results and discussion
4. Conclusions
References
A Robust Optimization Approach for Hydrogen Allocation Network with Parametric Uncertainties
Abstract
1. Introduction
2. Problem Definition and Mathematical Formulation
3. Illustrative Example:
4. Conclusions
References
Process Design and Techno-economic analysis of Hydrogen Production using Green Ammonia Imported from Australia- A Korea Case Study
Abstract
1. Introduction
2. Methods
3. Results and discussion
References
Life Cycle Assessment of Hydrogen Production from Imported Green Ammonia: A Korea Case Study
Abstract
1. Introduction
2. Methods
3. Conclusion
References
Optimal Design of Distillation Columns Using a Combined Optimisation Approach
Abstract
1. Introduction
2. Methodology
3. Case Studies
4. Conclusion
References
Process and product design for the simultaneous synthesis of xylitol and sorbitol from biomass
Abstract
1. Introduction
2. Process description
3. Modelling approach
4. Optimization procedure
5. Results
6. Conclusions
Acknowledgement
References
An approach for simultaneous computer-aided solvent design and process design for CO2 chemical absorption processes
Abstract
1. Introduction
2. Problem Formulation
3. Feasibility Tests
4. Case Study and Results
5. Conclusions
Acknowledgements
References
Simulation-based Derivative-free Optimization for Hybrid Separation Design
Abstract
1. Introduction
2. Solution Strategies
3. Case Study
4. Conclusions
References
Material Screening for Thermochemical Energy Storage in Solar Power Systems
Abstract
1. Introduction
2. Screening Methodology
3. Results
4. Conclusions
References
Network design optimization of waste management systems: the case of plastics
Abstract
1. Introduction
2. Problem statement and mathematical formulation
3. Case Study
4. Results and Discussion
5. Conclusions
References
Acknowledgements
Rational Design of Ionic Liquid Phase-Change Material for Efficient Thermal Energy Storage
Abstract
1. Introduction
2. Modeling
3. Results and Discussion
4. Conclusions
References
Tailor-made solvents by integrated design of molecules and CO2 absorption processes
Abstract
1. Introduction
2. The framework of 1-stage CoMT-CAMD
3. Equilibrium and transport properties based on PC-SAFT
4. Case study: Design of a carbon capture system with physical absorption
5. Conclusion
References
Small-scale GTL Applications with Heat Integration in Reforming and Fischer-Tropsch Stages
Abstract
1. Introduction
2. Methodology and Process Description
3. Results & Discussion
4. Conclusions
5. Acknowledgements
References
Automated Process Synthesis Using Reinforcement Learning
Abstract
1. Introduction
2. Methodology
3. Example case study and results
4. Conclusions
References
Operational Analysis of a Proton-Conducting Solid Oxide Electrolysis Cell for Synthetic Fuel Production
Abstract
1. Introduction
2. Modelling of Synthetic Fuel Production
3. Model Validation
4. Results and Discussion
5. Conclusions
References
Octane Optimization with a Combined Machine Learning and Optimization Approach
Abstract
1. Introduction
2. Method
3. Results and Discussion
4. Conclusions
5. References
A Platform of Machine Learning-Based Next-Generation Property Estimation Methods for CAMD
Abstract
1. Introduction
2. Methods
3. Results and Discussion
4. Conclusions
References
Machine Learning Analysis of the Feed Water Parameters Affecting Reverse Osmosis Membrane Operation
Abstract
1. Introduction
2. Methodology
3. Results
4. Conclusions
References
Novel technologies for low-quality natural gas purification
Abstract
1. Introduction
2. Methods
3. Process schemes
4. Results and discussion
5. Conclusions
References
The Influence of Cuttings Polydispersity on Wellbore Cleaning Operations using the Kinetic Theory of Granular Flow and the Dense Discrete Phase Model
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusions
References
A Digital Twin for Process Optimisation in Pharmaceutical Manufacturing
Abstract
1. Introduction
2. Salbutamol Manufacturing Process Description
3. A Digital Twin (DT) for VOC Capture and its Potential in Pharma 4.0
4. Conclusions
Acknowledgements
References
Development of Hybrid RTO approaches in the absence of a rigorous dynamic model by the use of Hammerstein model structures
Abstract
1. Introduction
2. Hammerstein model structure
3. HRTO architectures
4. Case Study: The Williams-Otto Reactor
5. Conclusion
References
Study of alternative configurations for methanol purification
Abstract
1. Introduction
2. Methodology
3. The considered schemes
4. Results
5. Conclusions
References
Power-to-OME1 via Direct Oxidation of Methanol: Process Design and Global Flowsheet Optimization
Abstract
1. Introduction
2. Process Concept
3. Flowsheet Optimization
4. Conclusion
References
A Machine Learning Approach for Device Design from Materials and Operation Data
Abstract
1. Introduction
2. Related Methods
3. Results and Discussion
4. Conclusions
5. Acknowledgments
6. References
A Computer-Aided Platform for Simultaneous Process Synthesis and Intensification
Abstract
1. Introduction
2. SPICE Framework
3. Case Studies
4. Conclusions
5. Acknowledgements
References
Studying the effect of solvent properties in treatment design within CO2 Integration Networks
Abstract
1. Introduction
2. Methodology
3. Mathematical Formulation
4. Results and Discussion
5. Conclusions
References
A Multi-generation system in Sabkha-Tah operating with nanofluids and a novel RO unit.
Abstract
1. Introduction
2. Methodology/Analysis
3. Results and Discussion
4. Conclusions
References
A POD-ROM Methodology for Optimal Structuring of a Non-isothermal Fixed-bed Reactor for Process Integration
Abstract
1. Introduction
2. Mathematical model and solution methodology
3. Results and discussion
4. Conclusions
Acknowledgements
References
Effect of Pseudo-Homogeneous Concentration Based Kinetics on Hybrid Reactive Distillation Columns for Selectivity Engineering
Abstract
1. Introduction
2. Design Methodology
3. Conclusions
References
An MILP model of post-combustion carbon capture based on detailed process simulation
Abstract
1. Introduction
2. Modeling
3. Application
4. Conclusion
References
Numerical study of fertilizer granules dynamics within rotary drum granulator
Abstract
1. Introduction
2. Mathematical Model development
3. Results and analysis
4. Conclusion
References
Application of PharmaPy in the digital design of the manufacturing process of an active pharmaceutical ingredient
Abstract
1. Introduction
2. Description of PharmaPy
3. Case studies
4. Conclusions
5. Acknowledgments
References
Computer-Aided Screening of Deep Eutectic Solvent Systems for the Associative Extraction of a-Tocopherol from Deodorizer Distillate
Abstract
1. Introduction
2. Method
3. Application
4. Conclusions
Acknowledgements
References
Investigating critical design criteria for photo-electrochemical reactors
Abstract
1. Introduction
2. Advantages and Disadvantages of PEC Reactor Types
3. Design Criteria - Single or Double Reactor
4. Initial Decisions During Reactor Design
5. Reactor Performance Indicators
6. Conclusions
References
Advanced exergoeconomic analysis of a double effect evaporation process in an instant coffee plant
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusions
References
Energy-efficient membrane cascades for industrial separations
Abstract
1. Introduction
2. Two novel membrane cascade optimization formulations
3. Exploring the potential of membrane cascades
4. Conclusions
5. Acknowledgement
References
Techno-economic evaluation of Carbfix technology for carbon storage in the US
Abstract
1. Introduction
2. Problem statement and methodology
3. Case study
4. Conclusions
Acknowledgments
References
Computational Exploration of Adsorption Enhanced Haber-Bosch using MOFs and Ionic Liquid/MOFs
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusions
Acknowledgment
References
Optimization of a Continuous Fluidized Bed Process for the Separation of Enantiomers by Preferential Crystallization
Abstract
1. Introduction. Enantiomers and process setup
2. Optimization of the process model
Conclusions
References
Appendix
Methanol and power production from waste tyres: a process synthesis approach
Abstract
1. Introduction
2. Methodology
3. Result and discussion
4. Conclusion
References
Analysing the robustness of multi-stage bioseparations to measurement errors
Abstract
1. Introduction
2. Error Analysis
3. Results
4. Conclusions
References
Improvements in Methyl Ethyl Ketone Production Through Intensified Processes
Abstract
1. Introduction
2. Intensified Alternative and Kinetics
3.Performance Evaluation Indices
3. Results
4. Conclusions
5. References
Flexibility Assessment of Spirits Distillation Processes: Focus on the Armagnac Distillation
Abstract
1. Introduction
2. Flexibility assessment
3. The Armagnac distillation case study
4. Results
5. Conclusions
References
OUTDOOR - An open-source superstructure construction and optimization tool
Abstract
1. Introduction
2. Programming and modeling fundamentals
3. OUTDOOR
4. An example: Power-to-methanol process
5. Conclusions
Funding
References
Probabilistic Modeling for Optimization of Bioreactors using Reinforcement Learning with Active Inference
Abstract
1. Introduction
2. Probabilistic modeling and active inference
3. Adaptive optimization-oriented experimental design
4. Case study: Baker´s yeast
5. Concluding remarks
References
SPH Simulation of the Rising of a Kerosene Bubble in a Water Column: Effect of the Injection Condition
Abstract
1. Introduction
2. The SPH Numerical Model
3. Simulation of ascending bubble.
4. Influence of Injection Conditions.
5. Conclusions.
References
Novel method for properties prediction of pure organic compounds using machine learning
Abstract
1. Introduction
2. Methodology
3. Results and discussion
4. Conclusions
References
Self-learning surrogate models in superstructure optimization
Abstract
1. Motivation and Background
2. Methodology
3. Case study
4. Preliminary results and discussion
5. Acknowledgments
References
Data-driven Modeling of an Industrial Ethylene Oxide Plant: Superstructure-based Optimal Design for Artificial Neural Networks
Abstract
1. Introduction
2. Methodology: Optimal Superstructure-based Design of ANNs
3. Results and Discussion
4. Conclusion
5. Acknowledgements
6. References
Novel Tool for Selecting Surrogate Modeling Techniques for Surface Approximation
Abstract
1. Introduction
2. Computational Experiments
3. Performance Metrics
4. Results and Discussion
5. Conclusions
References
ProREFD: Tool for Automated Computer-Aided Refrigerant Design, Analysis, and Verification
Abstract
1. Introduction
2. Overview of ProREFD and its embedded tools
3. Application Examples
4. Conclusion
References
Event driven analysis to enhance model calibration of experiments with high offline sampling rates
Abstract
1. Introduction
2. Materials and Methods
3. Results and Discussion
4. Conclusion
Acknowledgment
References
Process System Engineering Tool Integration in the Context of Industry 4.0
Abstract
1. Introduction
2. Phoenix Integration ModelCenter
3. Tool integration
4. Model Integration and applications
5. Conclusions
References
Benchmarking of Surrogate Models for the Conceptual Process Design of Biorefineries
Abstract
1. Introduction
2. Methods
3. Results & Discussion
4. Conclusion
Acknowledgments
References
Predicting the Estrogen Receptor Activity of Environmental Chemicals by Single-Cell Image Analysis and Data-driven Modeling
Abstract
1. Introduction
2. Experimental Data Gathering: High Content Image Analysis
3. Data Pre-Processing: Dimensionality Reduction
4. Data-Driven Model Building: Nonlinear Classification Algorithms
5. Results and Discussions
6. Conclusions
References
Data-driven prognostics for Lithium-ion battery health monitoring
Abstract
1. Introduction
2. Battery Data
3. SoH Classification
4. SoC Prediction
5. Conclusion
6. Acknowledgement
References
The Adaptive Radial Basis Method (ARBM): An application to the hydrodynamics of liquid-liquid dispersions
Abstract
1. Introduction
2. Solution of the PBE using the Adaptive Radial Basis Method (ARBM)
3. Model validation and discussion
4. Summary and Conclusions
Acknowledgment
References
Process modeling and multi-criteria optimization of an industrial phosphoric acid wet-process
Abstract
1. Introduction
2. Optimization problem formulation
3. Experimental data
4. Results and discussion
5. Conclusions
References
Towards Automated HAZOPs
Abstract
1. Introduction
2. Methodology
3. Applying the Tool
4. Conclusions
References
Multi-objective optimization of co-processing of algae hydrothermal liquefaction oil and vacuum gas oil: a survey of algal oil co-processing ratio and gasoline selling price
Abstract
1. Introduction
2. Materials and methods
3. Case study
4. Conclusion
Acknowledgement
References
Modeling of a software for sizing a wastewater treatment plant
Abstract
1. Introduction
2. Material and method
3. Results and discussion
Conclusion
References
Joint Chance Constraint Approach based on Data-Driven Models for Optimization Under Uncertainty applied to the Williams-Otto Process
Abstract
1. Introduction
2. Optimization under uncertainty
3. Data-driven input-output and uncertainty modelling
4. Case study
5. Conclusion and Outlook
References
CFD Simulations of High Efficiency Gas Cyclones: An Influence of Dustbin Geometry
Abstract
1. Introduction
2. CFD simulations
3. Validation
4. Results and discussion
5. Conclusions
Acknowledgement
References
InvQMOM: A Simple Inversion Method that Works
Abstract
Introduction
InvQMOM
Results and discussion
Conclusions
References
A Dual-Layer Attention-Based LSTM Network for Fed-batch Fermentation Process Modelling
Abstract
1. Introduction
2. Methodology
3. Results and discussions
4. Conclusions
References
Resilience and Survivability-aware Optimal Design and Operation of Interconnected Supply Chains
Abstract
1. Introduction
2. Resilience Analysis of Interconnected Networks
3. Economic Survivability of Supply Chains
4. Results
5. Conclusions
References
A Hybrid Modeling Approach for Liquid Entrainment Fraction Predictions
Abstract
1. Introduction
2. Liquid Entrainment Fraction Database
3. Hybrid Model Development Methodology
4. Results and Discussion
5. Conclusions
Acknowledgments
References
RETHINHING BALANCE MODELS APPLIED TO PFRS AND EXTRACTING NEW INSIGHTS
Abstract
1. Introduction
2. Theoretical basis
3. Results and Discussion
Additional insights derived from entropy analysis
Concluding Remarks
References
Digital Twin Model Development for Chemical Plants Using Multiple Time-Steps Prediction Data-Driven Model and Rolling Training
Abstract
1. Introduction
2. Methodology
3. Result and discussion
4. Conclusions
References
Parameter estimation and sensitivity analysis for a diesel hydro-processing model
Abstract
1. Introduction
2. Methods
3. Results and Discussion
4. Conclusion
References
Model Development of Amine Regeneration Process with Electrodialysis Reclamation Unit
Abstract
1. Introduction
2. Process description
3. Model development
5. Conclusions
Acknowledgments
References
CO2 methanation: Reactor modelling and parametric analysis
Abstract
1. Introduction
2. Kinetic scheme and mathematical model
3. Results
4. Conclusions
References
An uncertainty-aware hybrid modelling approach using probabilistic machine learning
Abstract
1. Introduction
2. Probabilistic hybrid model
3. Case study: A lab-scale flocculation of silica
4. Conclusions
5. Acknowledgements
References
Modelling and Dynamic Optimization of beer fermentation towards optimal flavor and operation
Abstract
1. Introduction
2. Methods
3. Results & Discussion
4. Conclusions
Nomenclature
References
On the fitting of bathtub-shaped failure models to lifetime data for selective maintenance optimization
Abstract
1. Introduction
2. Model fitting
3. Selective maintenance optimization
4. Conclusions
References
Sampling Space Reduction for Data-driven Modelling of Batch Distillation - Introducing Expert Process Knowledge through Operation Recipes
Abstract
1. Introduction
2. Methods
3. Results and discussion
4. Conclusion and outlook
5. Acknowledgements
References
On the acceleration of global optimization algorithms using a cutting plane decomposition and machine learning
Abstract
1. Introduction
2. Problem description and background
3. Proposed acceleration methodology and machine learning experiments
4. Results
5. Conclusions
6. Acknowledgement
References
Towards a Digital Twin: A validated Digital Model of a Pilot Scale Bioreactor producing Green Fluorescent Protein (GFP)
Abstract
1. Introduction
2. Digital Model Development
3. Challenges and Opportunities
4. Conclusions
5. Acknowledgement
References
Automated Box-Jenkins Methodology to Forecast the Prices of Crude Oil and Its Derivatives
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusions
References
Systematic Modelling of Transport Processes across Interfaces
Abstract
1. Motivation
2. Transport processes across all sorts of interfaces
3. Derivation of topology capacities
4. Concluding remarks of advisory
Acknowledgements
References
An identification approach to a reaction network for an ABE catalytic upgrade
Abstract
1. Introduction
2. Acetone, butanol and ethanol catalytic upgrade towards long-chain hydrocarbons
3. Kinetic modelling of the ABE upgrading
4. Results and discussion
5. Conclusions
References
MOSKopt: A simulation-based data-driven digital twin optimizer with embedded uncertainty quantification
Abstract
1. Introduction
2. Methods
3. Case studies
4. Conclusions
Acknowledgments
References
Global Optimization of Mixed-Integer Polynomial Programs via Quadratic Reformulation
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusion
References
A data-based approach for the development of asynchronous and distributed optimization algorithms in complex engineering applications
Abstract
1. Introduction and background
2. Methodological Approach
3. Implementation, illustration and results
4. Conclusions
Acknowledgement
References
9780323885133v2_WEB
Front Cover
31ST EUROPEAN SYMPOSIUM ON COMPUTER AIDED PROCESS ENGINEERING: Volume 2
Copyright
Contents
How tools and technologies help drive sustainability
Abstract
1. Introduction
2. The Digital Twin
3. Unified Engineering
4. Process Simulation lifecycle
5. Process Simulations for Sustainable Technology
6. Conclusion
References
A homotopy continuation-based branch and bound algorithm for process synthesis and design using rigorous unit operation models
Abstract
1. Introduction
2. Problem statement
3. Homotopy continuation-based branch and bound algorithm
4. Case study
5. Conclusions
References
ROmodel: A Python Robust Optimization Modeling Toolbox
Abstract
1. Introduction
2. Modeling
3. Solvers
4. Results
5. Conclusion
6. Acknowledgements
References
Modelling - Mechanistic reductionism extended with holistic empirical components
Abstract
1. Mathematical models - modelling
2. The Science Viewpoint
3. Different complexities
4. Scales
5. Disciplines & Interactions
6. On Boxes
7. ProMo's network of network approach
8. Need for Empirical Models
9. ProMo 's Handling of Multiplicity of Representations
10. Conclusions
Acknowledgments:
References
The state of play towards modeling of air quality in the city of Rabat
Abstract
References
Machine learning applications and process intelligence for cement industries
Abstract
1. Introduction
2. Background
3. Dataset
4. Methodology
5. Results
6. Conclusions and Future Work
References
Process Modelling and Simulation of Volatile Organic Compound (VOC) Recovery from Pharmaceutical Gas Emission Streams
Abstract
1. Introduction
2. Dynamic Process Modelling: Assumptions and Structure
3. Dynamic Model Parameters for Adsorption Systems
4. Results and Discussion
5. Conclusions
Acknowledgements
References
Multi-zonal compartmentalization methodology for surrogate modelling in continuous pharmaceutical manufacturing
Abstract
1. Introduction
2. Discrete element modelling
3. Multi-zonal compartmentalization methodology for surrogate modelling
4. Results
5. Validation of multi-zonal compartment model
6. Conclusions
7. Acknowledgements
References
ProMo variable/equation Ontology-based system modelling
Abstract
1. Introduction
2. The ProMo process modelling suite - an overview
3. ProMo's ontology builder
4. ProMo's equation editor
5. Concluding remarks
References
Multi-scenario Design Optimization using ADMM of a Thermal Energy Storage System
Abstract
1. Introduction
2. Methodology
3. The TES Design problem
4. Results and Discussions
5. Conclusion
References
Performance comparison of different optimization methods for the wastewater treatment plant model based on the Activated Sludge Model No. 3 and design of the plant control
Abstract
1. Introduction
2. Municipal WWTP model
3. Methods
4. Results and discussion
5. Conclusions
References
Comparison of Group-Contribution and Machine Learning-based Property Prediction Models with Uncertainty Quantification
Abstract
1. Introduction
2. Methodology
3. Results
4. Conclusions
References
Intelligent Management Platform for Material Exchange Optimization and Industrial Symbiosis
Abstract
1. Introduction
2. Background
3. Dataset and Model
4. Methodology
5. Results
6. Conclusions
References
Towards a Software Prototype for Synthesis of Operable Process Intensification Systems
Abstract
1. Introduction
2. Software Prototype
3. Case Study: Pentene Metathesis Reaction
4. Conclusion and Future Work
5. Acknowledgment
References
Data-driven modelling of choke valve erosion using data simulated from a first principles model
Abstract
1. Main Text
2. Gas lifted oil well network
3. Method
4. Results and discussion
5. Conclusion
6. Acknowledgements
References
A Metamodelling Approach for Air Pollution Source Estimation
Abstract
1. Introduction
2. Methodology
3. Experimental study
4. Results and discussion
5. Conclusion
Acknowledgements
References
Uncertainty analysis in life-cycle assessment of early-stage processes and products: a case study in dialkyl-imidazolium ionic liquids
Abstract
1. Introduction
2. Methodology
3. Case Study Definition
4. Results and Discussions
5. Conclusions
References
Interval-Valued Data Learning for Robustness of Energy Recovery Systems
Abstract
1. Introduction
2. Machine Learning for symbolic data
3. Application to HEN data
4. Conclusion
References
Rules for Predicting Benefits in Simultaneous versus Sequential Heat Integration
Abstract
1. Introduction
2. Methodology
3. Case Studies
4. Conclusion and future work
References
Processing systems design considering resilience
Abstract
1. Introduction
2. Synthesis of processing systems considering resilience
3. Case study
4. Conclusions
References
Applying quality assurance concepts from software development to simulation model assessment in smart equipment
Abstract
1. Introduction
2. State of the art in quality assessment of simulation models
3. State of the art in quality assessment of simulation models
4. Case Study
5. Conclusion
References
Studying the Synergy between Dimension Reduction and Clustering Methods to Facilitate Fault Classification
Abstract
1. Introduction
2. Dimension reduction techniques
3. Clustering methods
4. Case study
5. Results and discussion
6. Conclusions
References
Computational Fluid Dynamics Modelling of Phenol Oxidation in a Trickle-Bed Reactor using 3D Eulerian Model
Abstract
1. Introduction
2. Governing equations
3. Results
4. Conclusions
References
Enhanced deterministic approach for heat exchanger network synthesis
Abstract
1. Introduction
2. Mathematical Model
3. Optimization
4. Case study
5. Conclusions
References
Modelling Biogas and H2S in Anaerobic Digestion
Abstract
1. Introduction
2. Model improvements
3. Case Study
4. Conclusions
References
Implementation of first-principles surface interactions in a hybrid machine learning assisted modelling of flocculation
Abstract
1. Introduction
2. Modelling framework
3. Application example
4. Conclusion and future developments
5. Acknowledgment
References
Optimal physical property data for process simulations by optimal experimental design
Abstract
1. Introduction
2. Method: Calculation of c-optimal experimental designs
3. Case Study and Results
4. Conclusion
Acknowledgement
References
Continuous-Effort Approach to Model-Based Experimental Designs
Abstract
1. Introduction
2. Methodology
3. Case Study
4. Conclusion
References
Application of Machine Learning and Global Sensitivity Analysis for Identification and Visualization of Design Space
Abstract
1. Problem Setting
2. Machine Learning and Global Sensitivity Analysis
3. Visualization of Design Space
4. Conclusions
Acknowledgements
References
A Hybrid Model Coupling Advanced Oxidation Processes (AOP) and Conventional Bio-processes for the Removal of Recalcitrant Contaminants in Wastewaters
Abstract
1. Introduction
2. Methodology
3. Development of the integrated models
4. Simulation results
5. Conclusions
Acknowledgments
References
Analysis of the dissolution mechanism in the phosphoric acid manufacturing process: modelling and simulation
Abstract
1. Introduction
2. Model formulation
3. Phosphate ore dissolution modelling
4. Simulation and parameter identification
5. Results and discussion
6. Conclusions
References
Focusing experiments in the early phase process design by process optimization and global sensitivity analysis
Abstract
1. Introduction
2. Methodology
3. Case study
4. Conclusion and outlook
Acknowledgement
References
Design Space Approximation with Gaussian Processes
Abstract
1. Introduction
2. Theory
3. Results
4. Conclusions
References
Employing Adaptive Just-In-Time-Learning in a Transfer Learning Frame for Soft-Sensor Design
Abstract
1. Introduction
2. Online Learning Methods
3. Transfer Learning
4. The Proposed Method
5. Results and Discussion
6. Conclusion
References
AC-Optimal Power Flow Solutions with Security Constraints from Deep Neural Network Models
Abstract
1. Introduction
2. Overview of Methods
3. Results
4. Conclusions
References
The impact of CO2 pricing in SC Resilience - An optimisation model
Abstract
1. Introduction
2. Problem Characteristics and Model description
3. Case Study
4. Results and Discussion
References
Acknowledgements
Machine learning-based approach to identify the optimal design and operation condition of organic solvent nanofiltration (OSN)
Abstract
1. Introduction
2. Method
3. Result
4. Conclusions
References
Development of System Dynamic Model for Sustainability driven Technology Adoption in Indian Transport Sector
Abstract
1. Introduction
2. Model development
3. Results
4. Conclusion
References
Multi-Period Design Optimization of Flexible Fixed-Bed Reactors by Stoichiometry-Based Model Reduction
Abstract
1. Introduction
2. Heterogeneous Reactor Model
3. Multi-Period Design Optimization Problem
4. Results
5. Conclusion
6. Acknowledgment
References
Optimization based sampling for gray-box modeling using a modified upper confidence bound acquisition function
Abstract
1. Introduction
2. A novel optimization based sampling approach
3. Case study
4. Results
5. Conclusion and outlook
6. Acknowledgment
References
How to design cooperative sustainable industrial systems?
Abstract
1. Introduction
2. Methodology
3. Problem statement
4. Case study
5. Results and analysis
6. Conclusion
References
Population Balance Modelling of Pan Granulation Processes
Abstract
1. Introduction
2. Materials and Methods
3. Model adaption
4. Results
5. Conclusion
6. Acknowledgements
References
Estimation of cutpoint temperature under uncertain feed composition and process conditions using artificial intelligence methods
Abstract
1. Introduction
2. Process description
3. Methodology
4. Result and discussions
5. Conclusion
References
Application of Constrained EKF based State Estimation to a Coiled Flow Inverter Copolymerization Reactor
Abstract
1. Introduction
2. Experimental Setup
3. Model
4. Constrained Recursive State Estimation
5. Results
6. Conclusion
References
Towards Automated Information Retrieval of Process Data and Knowledge from Academic Databases
Abstract
1. Introduction
2. Problem Statement
3. Methodology
4. Case Study
5. Results and Discussion
6. Conclusions
Acknowledgements
References
Prediction of Bioconcentration Factors (BCF) using Graph Neural Networks
Abstract
1. Introduction
2. Background
3. Methodology
4. Results and discussion
5. Conclusion
6. Acknowledgments
References
Data and environment based approach for process systems engineering
Abstract
1. Introduction
2. General approach
3. Case study
4. Conclusion and perspectives
References
A Data-based Predictive Model for Distillation Column of Bio-based 2,3-Butanediol
Abstract
1. Introduction
2. Methodology
3. Results and discussion
4. Conclusions
Acknowledgments
References
Data-driven Process Design Exemplified on the Steam Methane Reforming Process
Abstract
1. Introduction
2. Methods
3. Results
4. Conclusions
Acknowledgement
References
Input transformation for linearization, decoupling and disturbance rejection with application to steam networks
Abstract
1. Introduction
2. New method for input transformation
3. Case study: steam network
4. Discussion
5. Conclusions
Acknowledgements
References
SEARCH: A Symptom-based Expert for Advanced Response to Chemical Hazards
Abstract
1. Introduction
2. Example SEARCH Platform: Chemical substance identification knowledge service based on symptom knowledge reasoning
3. Collection and Preprocessing of Chemical Substance and Symptom Information Data
4. Knowledge Base Generation and Reasoning
5. Symptom Knowledge Expansion Using Machine Learning
6. ConclusionBased on the input
References
A Cloud Computing Application for the Supercritical Carbon Dioxide Extraction Using Coffee Grounds Silverskin
Abstract
1. Introduction
2. Cloud Process Engineering Approach
3. Materials and Methods
4. Model
5. Results
6. Conclusions
References
Multi-objective optimization of the shape of a fixed-bed reactor
Abstract
1. Introduction
2. Description of the fixed-bed reactor and its modeling
3. Multi-objective optimization problem statement
4. Adjoint system method for the shape gradient computation
5. Implementation of the optimization algorithm
6. Numerical results and discussion
7. Conclusions
References
Artificial Intelligence Based Prediction of Exergetic Efficiency of a Blast Furnace
Abstract
1. Introduction
2. Process Description
3. Methodology
4. Results and Discussion
5. Conclusions
References
AI System for Supporting Generation of Optimal Synthetic Pathways Based on Chemical Reaction Big Data
Abstract
1. Introduction
2. Design of Reaction Knowledge Base: Reaction database sources, essential reaction information, automatic extraction, and representation as knowledge graph
3. One-step Retrosynthetic Prediction Using an Open-Source Model
4. Generation of Optimal Synthetic Pathway via Simultaneous Exploration of Knowledge Graph and Retrosynthetic Prediction
5. Results and Discussion
6. Conclusion
Acknowledgements
References
Application of data science to study fluorine losses in the phosphate industry
Abstract
1. Introduction
2. Background
3. Methods
4. Results and discussion
5. Conclusion
References
Data-driven Branch-and-bound Algorithms for Constrained Simulation-based Optimization
Abstract
1. Introduction
2. Methods
2. Results
3. Conclusions
References
Reactor scale modelling of gas hydrate-based CO2 capture (HBCC) process
Abstract
1. Introduction
2. Methodology
3. Results and Discussions
4. Conclusions
References
SMITH: differential homotopy and automatic differentiation for computing thermodynamic diagrams of complex mixtures.
Abstract
1. Introduction
2. Geometrical model of univolatility curves
3. SMITH algorithm
4. Further perspectives
References
Dynamic modeling of a three-phase gas-solid-liquid fluidized bed absorber for CO2 capture
Abstract
1. Introduction
2. Mathematical model
3. Results and discussions
4. Conclusions
Acknowledgements
References
Steady and Dynamic State Simulation-based Study of the Coupling of Electrolysis and Methanation Processes within Power to Methane (PtM) Context
Abstract
1. Introduction
2. Model formulation
3. Computational and simulation aspects
4. Results and discussion
5. Conclusions
References
Upgraded Meta-Learning based Surrogate Selection Paradigm (LEAPS2v2)
Abstract
1. Introduction
2. LEAPS2 and its Limitations
3. LEAPS2 Version 2 (LEAPS2v2)
4. LEAPS2v2 Performance
5. Conclusions
References
Flexibility analysis of chemical processes considering dependencies between uncertain parameters
Abstract
1. Introduction
2. Flexibility Index
3. Example
4. Results and Discussion
5. Conclusion
References
Computational Characterization of a Pore Network Model by Using a Fast Nitrogen Porosimetry Simulation
Abstract
1. Methodology for the Simulation of the Characterization Techniques
2. Simulation of Nitrogen Porosimetry Curves
3. Case Study
4. Conclusions
References
Acyclic modular flowsheet optimization using multiple trust regions and Gaussian process regression
Abstract
1. Introduction
2. Background
3. Multiple trust regions and Gaussian processes for optimization
4. Computational case-study
5. Conclusion
References
Systematic generation and targeting of chemical recycling pathways: A mixed plastic waste upcycling case study
Abstract
1. Introduction
2. Problem Statement
3. Methodology
4. Case Study
5. Results and Discussion
6. Conclusions
Acknowledgements
References
Calibration of an EPANET model by using monitoring points in the bulk distribution of Sedibeng Water, for predicting disinfectant decay
Abstract
1. Introduction and Context
2. Disinfectant Decay
3. 3. Model Calibration
4. Discussion
5. Conclusions
References
Compartmental Modelling of Shell Side Fouling in a Shell and Tube Heat Exchanger
Abstract
1. INTRODUCTION
2. Results and conclusions
References
Optimization-based digital design of a commercial pharmaceutical crystallization process for size and shape control
Abstract
1. Introduction
2. Experimental Methods, Model Development, Parameter Estimation, and Process Optimization
3. Results and Discussion
4. Conclusions
Acknowledgements
References
CONDITION NUMBER AS A QUANTITATIVE MEASURE OF FLEXIBILITY IN A PROCESS
Abstract
1. Introduction
2. Methodology
3. Results
4. Conclusions
5. References
Nonlinear Model Predictive Control of Food Sterilization Processes
Abstract
1. Introduction
2. Process description and modeling
3. Control framework
4. Operation analysis and discussion of results
5. Conclusions
References
Design and control of triple-column pressure swing distillation process for acetone-methanol-hexane separation
Abstract
1. Introduction
2. Process Studied and Methods
3. Results and Discussion
4. Conclusions
References
Design and control of a Biobutanol Purification Process through IBE Fermentation: Basic Design Configuration
Abstract
1. Introduction
2. Process Studied
3. Results and Discussion
4. Conclusions
Acknowledgment
References
Fault Diagnosis of Electrical Power Systems with Hybrid Quantum-Classical Deep Learning
Abstract
1. Introduction
2. Background
3. Hybrid Quantum-Classical Fault Diagnosis Model
4. Computational Results : IEEE 14-Bus System
5. Conclusions
References
Data-Driven Robust MPC for Controlled Environment Agriculture
Abstract
1. Introduction
2. Greenhouse Dynamic Model Formulation
3. Control Strategies
4. Case Study
5. Conclusions
References
Initialization strategy for the dynamic optimization of a batch distillation column with a rate-based model
Abstract
1. Introduction
2. Methodology
3. Results
4. Conclusions
Acknowledgements
References
Adversarial Autoencoder Based Nonlinear Process Monitoring
Abstract
1. Introduction
2. AAE based fault detection
3. Case study
4. Conclusion
References
Machine learning for constrained self-optimizing control
Abstract
1. Introduction
2. Constrained gSOC formulation and CV selection
3. Case study
4. Conclusions
Acknowledgement
References
Driving Force Based Design and Control Performance Analysis of Reactive Distillation Columns
Abstract
1. Introduction
2. Integrated design-control framework for RD systems
3. Integrated design-control toolbox for RD systems
4. Application example
5. Conclusions
References
Generating an optimal control policy via apprenticeship and reinforcement learning
Abstract
1. Introduction
2. Methodology
3. Case Study
4. Results and Discussion
5. Conclusions
References
Systematic model-based dynamic optimization of a combined cooling and antisolvent multistage continuous crystallization process
Abstract
1. Introduction
2. Materials and Methods
3. Results and Discussion
4. Conclusion
References
Predicting Microclimate of a Closed Greenhouse Using Support Vector Machine Regression
Abstract
1. Introduction
2. Greenhouse data
3. Methodology
4. Results and Discussion
5. Conclusion
Acknowledgment
References
Adjustable Robust Optimal Control for Nonlinear Chemical Process under Uncertainty
Abstract
1. Introduction
2. Model formulation
3. ARDO reformulations
4. Case study: Williams-Otto semi-batch
5. Conclusion
Acknowledge
References
Adaptive Optimal Control of Baker's Yeast Fermentation Process with Extreme Learning Machine and Recursive Least Square Technique
Abstract
1. Introduction
2. Batch-to-Batch Modelling with an Updated ELM Model
3. Application to a Fed-Batch Fermentation Process
4. Conclusions
Acknowledgement
References
Data-based Industrial Soft-sensor Design via Optimal Subset Selection
Abstract
1. Introduction
2. Problem Description
3. Soft-sensor Design by Optimal Subset Selection
4. Results
Conclusions
References
Economic MPC with Modifier Adaptation using Transient Measurements
Abstract
1. Introduction
2. Modifier Adaptation using transient measurements (TMA)
3. eMPC+TMA formulation
4. Williams-Otto Case study
5. Conclusions
6. Acknowledgments
References
Attack Detection Using Unsupervised Learning Algorithms in Cyber-Physical Systems
Abstract
1. Introduction
2. Methodology
3. Procedure and Results
4. Conclusion
References
Application of Self-Optimizing Control in a Real Heat Exchanger Network
Abstract
1. Introduction
2. Theory
3. Case Study
4. Results
5. Conclusions
References
Data-Driven Control Strategies for the Autonomous Operation of the Pharmaceutical Crystallization Process
Abstract
1. Introduction
2. Methods
3. Results and Discussion
4. Conclusions
References
Dynamic optimization of a stand-alone alkaline water electrolyzer for future operation using a predicted solar forecast
Abstract
Nomenclature
1. Introduction
2. Method
3. Results
4. Conclusion
Acknowledgments
References
A Mixed Integer Dynamic Optimization Approach for a Hybrid-Stand Alone Solar and Wind Powered Alkaline Water Electrolyser for Renewable Hydrogen
Abstract
Nomenclature
1. Introduction
2. Method
3. Results
4. Conclusion
Acknowledgments
References
A framework for adaptive online model-based redesign of experiments in dynamic systems
Abstract
1. Introduction
2. Problem statement
3. Methodology
4. Case study
5. Conclusion
References
Investigation of the use of transient process data for steady-state Real-Time Optimization in presence of complex dynamics
Abstract
1. Introduction
2. Real-time optimization frameworks
3. Illustrative example: the Van de Vusse CSTR
4. Conclusion
References
Evaluating Control Room Operator Training Outcomes Through Eye Gaze Augmented Multi-Scale Data
Abstract
1. Introduction
2. Experimental setup and methodology
3. Results and Discussion
4. Conclusions
References
Multi-layer Multivariate Statistical Analysis for Process Monitoring
Abstract
1. Introduction
2. Construction of Proposed Model
3. Case study
4. Conclusions
References
Digitalization, Control and Optimization for Cement Plants
Abstract
1. Introduction
2. Cement related Industrial MPC Applications
3. CCUS & Power-2-X Technologies
4. Conclusion
References
Process Monitoring with Advanced Analytics for Improved Plant Efficiency in the Pharmaceutical Industry
Abstract
1. Introduction
2. Salbutamol Manufacturing Process Description
3. Principal Component Analysis (PCA) Methodology
4. First Case Study: Results and Discussion
5. Second Study: Results and Discussion
6. Conclusions
Acknowledgements
References
A Study of Spectral Envelope Method for Multi-Cause Diagnosis using Industrial Data
Abstract
1. Introduction
2. Detection and Diagnosis with the Spectral Envelope Method
3. Refinery Case Study
4. Results and Discussion
5. Conclusion
References
Dynamic Model Based Detection of Cyberattacks in Industrial Facilities
Abstract
1. Introduction
2. Extended Data Reconciliation Gross Error Detection
3. Considering Dynamic System Relations
4. Evaluation
5. Conclusion
References
Evaluation of control strategies in CO2 capture unit
Abstract
1. Introduction
2. Process Description
3. Evaluation of Control Strategy
4. Results and Discussion
5. Conclusions
References
Modelling and Temperature Uncertainty Analysis of a Fermentation Bioreactor at an Industrial Brewery
Abstract
1. Introduction
2. Mathematical Modelling
3. Stochastic dynamic modelling under uncertainty
4. Results
5. Conclusions
References
Symbolic transfer entropy for root cause analysis of process disturbances
Abstract
1. Introduction
2. Methodology
3. Case study
4. Conclusion
References
Control of Batch and Continuous Crystallization Processes using Reinforcement Learning
Abstract
1. Introduction and Background
2. Problem Formulation
3. Results and Discussion
4. Conclusion
References
9780323885133v3_WEB
Front Cover
31ST EUROPEAN SYMPOSIUM ON COMPUTER AIDED PROCESS ENGINEERING: Volume 3
Copyright
Contents
Process Monitoring under Uncertainty: An Opportunity for Bayesian Multilevel Modelling
Abstract
1. Introduction
2. Modelling approach
3. Computational Methodology
4. Results and Discussion
5. Conclusions
References
Modelling and Health Monitoring of a Pressure Regulating System
Abstract
1. Introduction
2. First Principles Model and NN Surrogate for PRS
3. Monitoring Filter Choking on Gas Distribution Network Data
4. Conclusions
Acknowledgements
References
Unsupervised Monitoring of Flocculation Processes based on Recurrence Theory
Abstract
1. Introduction
2. Experiment
3. Theory
4. Application on silica flocculation process
5. Conclusions
Acknowledgement
References
Optimal Supply Chain for Renewable Furfural Production Involving Economic, Environmental and Social Criteria
Abstract
1. Introduction
2. Methodology
3. Mathematical Model
4. Results
5. Conclusions
Acknolwledgements
References
Levels of Approximation for the Optimal Design of Distributed Energy Systems
Abstract
1. Introduction
2. Methodology
3. Results
4. Conclusions
References
A Coordinated Framework for the Optimization of Municipal Solid Waste Management
Abstract
1. Introduction
2. System Description
3. Coordinated Framework
4. Model Formulation
5. Results and Discussion
6. Conclusions
References
A Probabilistic Scenario Generation Framework for Optimal Decision Making in Turkish Renewable Energy Market
Abstract
1. Introduction
2. Theoretical Background
3. Scenario Generation
4. Results
5. Case Study
6. Conclusion
7. Acknowledgement
References
Dynamic optimization modelling for a national-scale energy system in transition
Abstract
1. Introduction
2. Model description
3. Scenarios analyses
4. Conclusion
5. Acknowledgements
References
Carbon Policy Assessment in Process Integration
Abstract
1. Introduction
2. Methodology
3. Case Study
4. Conclusions
References
Back-End Design and Development of an Energy Systems Analysis Tool
Abstract
1. Introduction
2. Methodology
3. Case Examples
References
Compression system power requirements for various CO2 sources and transportation options
Abstract
1. Introduction
2. CO2 Sources
3. Process Simulation
4. Results and Discussion
5. Conclusions
6. Acknowledgements
7. References
Life Cycle Optimization of Hybrid Energy Systems towards Carbon Neutrality
Abstract
1. Introduction
2. Superstructure Generation
3. Model Formulation
4. Application to Cornell Campus Energy System
5. Conclusion
References
Value of aggregator-led community energy storage systems with degradation constraints
Abstract
1. Background
2. Problem description
3. Model description
4. Case study
5. Results & Discussion
6. Conclusion
Acknowledgement
References
Clean Electricity Generation from Sewage: a novel Ultra-Supercritical Water Oxidation Technology with integrated CCS
Abstract
1. Introduction
2. Methodology
3. Results and Discussions
4. Conclusions
Acknowledgements
References
Design of Food-Energy-Water-Waste Nexus Systems in New York State under COVID-19 Pandemic
Abstract
1. Introduction
2. Problem Statement
3. Results and Discussion
4. Conclusions
References
Assessment strategies of different molten salts for heat transfer in tri-generation systems
Abstract
1. Introduction
2. Methodology
3. Mathematical Formulation
4. Case Study
5. Conclusions
References
Techno-economic Assessment of Load Following Operation for Super-critical Power Plants Equipped with Carbon Capture Feature
Abstract
1. Introduction
2. Design of decarbonized super-critical power plant, main model assumptions and thermal integration analysis
3. Base-load and flexible techno-economic and environmental assessment
4. Conclusions
Acknowledgments
References
Utilisation of CO2 in transnational LNG supply chain for the enhancement of jet fuel production in globally decentralised GTL industries
Abstract
1. Introduction
2. Methodology
3. Results
4. Conclusion
5. References
River Water Quality Prediction in Malaysia Based on Extra Tree Regression Model Coupled with Linear Discriminant Analysis (LDA)
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusion
Acknowledgment
References
Synthesis and Design of Sustainable Integrated Process, Water Treatment, Energy Supply Networks and Carbon Utilization Networks Under Uncertainty
Abstract
1. Introduction
2. Framework and Modeling
3. Case Study
4. Case Study
References
Optimising the Sustainability Performance of an Industrial Park: an Energy-Water-Food Nexus
Abstract
1. Introduction
2. Network superstructure
3. Results and discussion
4. Conclusion
5. Acknowledgment
References
A Study to Target Energy Consumption in Wastewater Treatment Plant using Machine Learning Algorithms
Abstract
1. Introduction
2. Problem statement and data description
3. Methodology development using machine learning algorithms
4. Results and Discussions
5. Conclusion
Acknowledgement
References
Development of sustainable integrated biorefinery networks in pulp and paper industries
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusion
Acknowledgement
References
Optimization of biogas autothermal reforming integrated with PEM based on renewable energy
Abstract
1. Main Text
2. Process description
3. Optimization of the proposed ATR-PEMLO system
4. Result and discussion
5. Conclusions
References
Integration of CO2 capture to power plants: the effect of fuel and gas composition in process configuration
Abstract
1. Introduction
2. Study Cases and Methodology
3. Results
4. Conclusions
References
Optimal Integration of Renewables, Flexible Carbon Capture, and Energy Storage for Reducing CO2 emissions from Fossil Power Plants
Abstract
1. Main Text
2. Model Formulation and Solution Strategy
3. Integration Case Study
4. Conclusions
5. Acknowledgements
References
Circular Economy Systems Engineering: A case study on the Coffee Supply Chain
Abstract
1. Introduction
2. Coffee Supply Chain
3. CE Systems Engineering Framework
4. Discussion of Results
5. Conclusions
6. Acknowledgments
References
Towards a Circular Economy Calculator for Measuring the "Circularity" of Companies
Abstract
1. Introduction
2. Circular Economy Metric Development
3. Case Study: "Circularity" Index of an Industrial Gas Company
4. Results
5. Conclusions
6. Acknowledgements
References
Economic Optimization of Qatar's Hydrocarbon-based Fuels for Sustainable Maritime Applications
Abstract
1. Introduction
2. Problem Definition
3. Mathematical Modelling
4. Results
5. Conclusions
6. Acknowledgment
7. References
Unmanned aerial vehicles in precision agriculture towards circular economy: a process system engineering (PSE) assessment
Abstract
1. Introduction
2. Unmanned aerial vehicle impacts in precision agriculture
3. Agricultural production operations and risks towards circular economy
4. Results
5. Conclusion
Acknowledgment
References
Utilisation of Carbon Dioxide and Gasified Biomass for the Generation of Value Added Products
Abstract
1. Introduction
2. Model development
3. Results and discussion
4. Conclusions
References
Synthesis of the EU Supply Networks for the Gradual Transition to 100 % Renewable Energy Production
Abstract
1. Introduction
2. Approach to the sustainable synthesis of renewable supply networks
3. EU-27 case study
4. Conclusions
References
Simultaneous optimization and heat integration of a macroalgae-based biorefinery
Abstract
1. Introduction
2. Mathematical modeling
3. Numerical Results
4. Conclusion
References
Integrated optimization of Multi-Energy System operation and thermal comfort management for buildings
Abstract
1. Introduction
2. Problem statement
3. Energy system and buildings modelling
4. Case study
5. Results
6. Conclusions and future works
References
Towards a Rational, Quantum-Chemistry-Based Selection and Screening of Green Solvents for Liquid-Liquid Phase Transfer Catalysis
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusion
Acknowledgements
References
A Model-Centric Multivariate Analysis for Reducing 2 Emissions in Wastewater Treatment Plants
Abstract
1. Introduction
2. Background
3. Multivariate analysis for a wastewater treatment plant
4. Results
5. Conclusions
References
Gas-to-liquid strategy for liquid fuel production from industrial residue gases: Process development and technoeconomic analysis
Abstract
1. Introduction
2. Process simulation and analysis method
3. Techno-economic analysis
4. Conclusions
Acknowledgment
References
Multi-Objective Optimization of Lignocellulosic Ethanol Production Based on Regional Land and Water Availability
Abstract
1. Introduction
2. Modeling framework
3. Case study of Maharashtra, India
4. Result and discussion
5. Conclusion
Reference
Deep Learning and AutoML for Dynamic Modeling of LNG Regasification Process Using Seawater
Abstract
1. Introduction
2. LNG Regasification Process
3. Dynamic Modeling Using ANN
4. Performance of Dynamic Prediction Models
5. Application of Developed Dynamic Model
6. Conclusions
References
Acknowledgements
Carbon or Nitrogen-based e-fuels? A comparative techno-economic and full environmental assessment
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusion
5. References
Techno-economic assessment of a renewable energy-based electric vehicle fast-charging station in Qatar
Abstract
1. Introduction
2. Methodology
3. System description
4. Load profile and resources input modeling
5. Simulation and optimization results
6. Conclusions
References
Simultaneous Synthesis and Optimization of Refrigeration Cycles and Heat Exchangers Networks
Abstract
1. Introduction
2. Problem Statement and Methodology
3. Reverse Rankine Cycle and HEN Superstructures
4. Optimization Approach
5. Case Study and Results
6. Conclusions
References
Waste- to-DME: Process Synthesis and Sustainability Evaluation
Abstract
1. Introduction
2. Modelling framework
3. Results and Discussion
4. Conclusions
References
Long-distance hydrogen delivery using a toluene-based liquid organic hydrogen carrier system
Abstract
1. Introduction
2. Process overview and modelling
3. Process simulation results
4. Heat integration and economical analysis
5. Conclusions
References
Assessment of energy efficiency improvement in ceramic industry through waste heat recovery modelling
Abstract
1. Introduction
2. Modelling of Thermal Processes and Process Integration
3. Techno-economic assessment
4. Conclusions
The assembled References
Acknowledgements
Targeting and Optimisation of Industrial and Urban Symbiosis for Circular Economy
Abstract
1. Introduction
2. System representation, model and evaluation method
3. Case study
4. Conclusions
Acknowledgement
References
Negative CO2 emissions in biomass gasification process with hybrid amine-deep eutectic solvents
Abstract
1. Introduction
2. Gasification process
3. CO2 capture process
4. Energy production
5. Conclusions
Acknowledgments
References
Development and optimization of an energy efficient and self-sustained integrated process for nitrogen removal for baseload LNG plant
Abstract
1. Introduction
2. Process Description
3. Solution procedure
4. Results
5. Conclusions
References
Integration of Green Power in a Gas to Liquid Process
Abstract
1. Introduction
2. Process modelling
3. Considered cases
3. Results
4. Conclusions
References
Comparative Study of Different Hybrid Life Cycle Assessment Methodologies Applied to Biomass-based Chemical Production
Abstract
1. Introduction
2. Process LCA and Hybrid LCA
3. Methodologies
4. Case Study Results: Bio-based Chemical Production
5. Conclusions
Acknowledgement
References
Optimising the energy, water and food nexus node to support decision making for sustainable food security in Risky Environments
Abstract
1. Introduction
2. Linear programming optimisation framework for EWF Nexus
3. Geospatial optimisation model application
4. Conclusion
Acknowledgments
References
Synthesis of Sunlight, Seawater and CO2 based Industrial Parks
Abstract
1. Introduction
2. Methodology
3. Case Study
4. Conclusion
References
Planning production of solar grade silicon to yield solar panels involving behaviour of population
Abstract
1. Introduction
2. Problem statement
3. Optimization model
4. Case study
5. Results
6. Conclusions
References
Bi-level Mixed-Integer Data-Driven Optimization of Integrated Planning and Scheduling Problems
Abstract
1. Introduction
2. The DOMINO Algorithm and its Extension to Multi-Follower Systems
3. Case Study for Bi-level Production Planning and Scheduling
4. Results
5. Conclusions and Future Work
References
A Prospective Approach in the Design of Lignin-Based Products Supply Chains
1. Abstract
2. Context
3. Research approach
4. Results
5. Conclusions
References
Flexibility Analysis in Supply Chain Management: Application to the Traveling Salesman Problem
Abstract
1. Introduction
2. Flexibility assessment
3. The TSP under uncertainty case study
4. Results
5. Conclusions
References
Production scheduling of continuous make-and pack processes with byproducts recycling
Abstract
1. Introduction
2. Problem statement
3. MILP model
4. Application studies
5. Conclusions
Acknowledgements
References
Robust Optimization for Scheduling and Lot-sizing of a Single Machine with Sequence-dependent Changeovers
Abstract
1. Introduction
2. Problem statement
3. Deterministic optimization model
4. Robust counterpart
5. Real-world case study
6. Conclusions
References
Simultaneous minimization of minimum resource and storage requirements in batch process
Abstract
1. Introduction
2. Problem Statement
3. Mathematical Formulations
4. Illustrative Example
5. Conclusions
Nomenclatures
References
A Hybrid Solution Approach for Large-scale Batch Scheduling with Quantum Computing
Abstract
1. Introduction
2. Quantum Computing Background
3. Multi-purpose Batch Process Scheduling
4. Conclusions
References
A Digital Twin Framework for Business Transactional Processes in Supply Chains
Abstract
1. Introduction
2. Methods
3. Case Study
4. Sensitivity Analysis
5. Conclusions
References
A Data-Driven Approach to Plan Electricity Production from Diesel Engines with Constrained Parameters
Abstract
1. Introduction
2. Problem statement
3. Methodology
4. Case Study
5. Conclusion
Acknowledgement
References
An Efficient Computational Strategy for Process Scheduling: a Case Study of the Omsk Lubricant Plant
Abstract
1. Introduction
2. Discrete-time mathematical formulation
3. Solution strategy
4. Case study
4. Case study
5. Conclusions
References
Centralised vs. decentralised production and storage: optimal design of a decarbonised hydrogen supply chain with multiple end uses
Abstract
1. Introduction
2. Text
3. Case study
4. Results
5. Conclusions
References
Optimal Design of the Reverse Logistics Network of Empty Agrochemical Containers
Abstract
1. Introduction
2. Mathematical Programming Formulation
3. Computational Results
4. Conclusions and future work
References
Designing a Rectification Strategy for Managing Disruptions in LNG Supply Chain
Abstract
1. Introduction
2. Agent-Based Model of LNG Supply Chain
3. Demand Disruption Case Study
4. Concluding Remarks
References
Statistical Decision-Theoretic Risk Management for Planning Renewable Energy Pathways
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusions
References
Supply Chain Planning with Vehicle Allocation for Gas Industry
Abstract
1. Introduction
2. Problem Statement
3. Mathematical Frameworks
4. Solution Approaches
5. Case study and Results
6. Conclusions
References
Optimal Day-Ahead Load Curtailment for Central Chiller Plants
Abstract
1. Introduction
2. Methodology
3. Case-Study Results
4. Conclusions
References
Interplaying of food supply chain resilience, industry 4.0 and sustainability in the poultry market
Abstract
1. Introduction
2. Supply chain resilience and sustainability connections
3. Interplaying of food supply chain resilience, industry 4.0 and sustainability
4. Poultry market value chain
5. Conclusion
Acknowledgment
References
Integrated Spatially Explicit Landscape and Biofuel Supply Chain Network Design
Abstract
1. Introduction
2. Spatially explicit two-stage stochastic model
3. Case study results
4. Conclusions
References
Techno-economic and environmental assessment of Gasoline produced from GTL and MTG processes
Abstract
1. Introduction
2. Model development
3. Results and discussion
4. Conclusions
References
Simplified targeting models for Sustainable Supply Chains retrofitting in process industries
Abstract
1. Introduction
2. Problem statement
3. Mathematical Model
4. Case Study: Retrofitting of integrated Sugar-bioethanol SCs
5. Results
6. Conclusions
Acknowledgments
References
Flexibility-expansion planning for enhanced balancing-power market participation of decentralized energy systems
Abstract
1. Introduction
2. Flexibility-expansion planning for balancing-power markets
3. Case study
4. Conclusions
Acknowledgment
References
A fair profit allocation model for the distribution plan optimisation of refined products supply chains
Abstract
1. Introduction
2. Problem description
3. Mathematical model
4. Case study
5. Conclusions
6. Acknowledgements
References
Markov Decision Process to Optimise Long-term Asset Maintenance and Technologies Investment in Chemical Industry
Abstract
1. Introduction
2. Methodology
3. Model formulation
4. Case study and results
5. Conclusion
Acknowledgement
6. References
Cost, environmental and exergy optimization of hydrogen and methane supply chains: application to Occitania region, France
Abstract
1. Introduction
2. Methods and tools
3. Results and discussion
4. Conclusion and perspectives
References
Planning of non-conventional gas field development with parametric uncertainties
Abstract
1. Introduction
2. Problem Statement
3. Model Formulation
4. Illustrative Example
5. Conclusion
References
Effect of the lignin extraction process on the economics of a woody-based biorefinery
Abstract.
1. Introduction.
2. Methodology.
3. Results and Discussion.
4. Conclusions.
References
Economic and environmental assessment of bio-hydrogenated diesel production process from waste cooking oil integrated with reforming process
Abstract
1. Introduction
2. Methodology
3. Results and Discussions
4. Conclusions
Acknowledgment
References
Modelling and simulation of a multiple feedstock integrated biorefinery for the production of aviation biofuel and other biofuels
Abstract
1. Introduction
2. Process design and simulation
3. Economic and environmental assessment
4. Results
5. Conclusions
6. Acknowledgments
References
Coordinated Management of Agricultural Waste and High-tech Value Bioproducts
Abstract
1. Introduction
2. Case of Study
3. Coordination Framework
4. Results
5. Conclusions
References
A design and optimization framework for (bio-)chemical process based on exergo-economic and environmental aspects.
Abstract
1. Introduction
2. A design and optimization framework for (bio-)chemical process based on sustainability aspects
3. Case study
4. Framework description
5. Results
6. Conclusion
7. Acknowledgments
8. References
Integrating Process Simulation and Life Cycle Assessment to Evaluate the Economic and Environmental Performance of Algae Biodiesel
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusions
References
Optimization of biogas production from cattle manure by anaerobic digestion using a gradient-based algorithm
Abstract
1. Introduction
2. Mathematical model of anaerobic digestion
3. Optimization
4. Numerical results and discussion
5. Conclusions
Acknowledgements
References
Photosynthetic Bioplastics Production with Cyanobacteria by Coupled Growth-Production Mutants
Abstract
1. Introduction
2. Methods
3. Results and Discussion
4. Conclusions
References
Parametric analysis of mammalian cell (GS-NS0) culture performance for advanced mAb biopharmaceutical manufacturing
1. Introduction
2. Dynamic model for mAb production from a GS-NS0 cell culture
3. Dynamic simulation of mAb production
4. Parametric analysis methodology
5. Local parametric sensitivity analysis
6. Conclusions
Acknowledgements
References
A technoeconomic assessment of an on-site biocrude production from sewage sludge in Qatar's wastewater treatment plants
Abstract
1. Introduction
2. Methodology
3. Results and Discussion
4. Conclusion
References
Production costs of advanced biofuels using a multi-component learning curve model
Abstract
1. Introduction
2. Methodology
3. Results
4. Conclusions
References
Simulation of the Biofuel Production Process from Organic Fraction of Municipal Solid Waste (OFMSW)
Abstract
1. Introduction
2. Methodology
3. Simulation results
4. Conclusions
5. Acknowledgments
References
Comparison of different processing routes for the valorisation of olive tree pruning wastes
Abstract
1. Introduction
2. Materials and Methods
3. Results and Discussion
4. Conclusion
References
The Use of GVL for Holistic Utilization of Biomass
Abstract
1. Introduction
2. Bottlenecks in lignin processing and extraction
3. The "Lignin-first" concept
4. Methodological steps
5. Results
6. Conclusions
Acknowledgments
References
Valorization of sugarcane bagasse to lactic acid: Life cycle assessment and Techno-economic evaluation in Indian scenario
Abstract
1. Introduction
2. Process Development
3. Methodology
4. Results and discussion
5. Conclusions
References
Hybrid Cybernetic Modeling of the Microbial Production of Polyhydroxyalkanoates Using Two Carbon Sources
Abstract
1. Introduction
2. Experimental Methods
3. Mathematical Model
4. Results
5. Conclusion
References
Microbial Production of Polyhydroxyalkanoates - Modeling of Chain Length Distribution
Abstract
1. Introduction
2. Model Formulation
3. Numerical Solution
4. Results
5. Conclusion
References
Identifiability of metabolic flux ratios on carbon labeling experiments
Abstract
1. Introduction
2. Methodology
3. Case study
4. Results
5. Conclusion
Acknowledgments
References
Metabolic Network Reconstruction from Time-Series of Concentration Data: Evaluation of the Numerical Matrices Methods
Abstract
1. Introduction
2. Numerical Matrices Methods (NMM)
3. Numerical Experiments
4. Results
5. Conclusion
References
Assessment of intermediate storage and distribution nodes in personalised medicine
Abstract
1. Introduction
2. Materials and methods
3. Results and discussion
4. Conclusions
References
Thermal treatment in dairy processes: Validation of protein deposition models
Abstract
1. INTRODUCTION
2. Model Validation
3. Discussion and Conclusions
References
Data-driven prediction of antiviral peptides based on periodicities of amino acid properties
Abstract
1. Introduction
2. Methods
3. Results
4. Conclusions
References
Allosteric Regulation of CRYs in Mammalian Circadian Clock
Abstract
1. Introduction
2. Materials and Methods
3. Results
Conclusions
References
Reflections on the development of scenario and problem-based chemical engineering projects
Abstract
1. Introduction
2. Problem-based learning through Scenarios
3. Scenario examples
4. Discussion
5. Conclusions
References
Programming skills across the (bio)engineering curriculum - a students' perspective
Abstract
1. Introduction
2. Methods
3. Results and Discussion
4. Conclusions
References
Engineering Social Responsibility: Rising to the Challenge of Sustainable Development
Abstract
1. Background
2. Sustainable Development
3. The SAMITE Workspace
4. Conclusion
References
Virtualization of Pressure Control Demonstration Unit - A Step Towards Virtual Laboratory
Abstract
1. Introduction
2. Case Study and Methods
3. Results
4. Conclusions
Acknowledgements
References
Complementarities of part-time and full-time postgraduates in process systems engineering (PSE): when industry and academia merges
Abstract
1. Introduction
2. Previous literature on PSE/CAPE tools for teamwork applications
3. Postgraduates from industry and academia
4. Example of a merge of industry and academia
5. Conclusions
References
Building Knowledge Capacity for Quantum Computing in Engineering Education
Abstract
1. Introduction
2. The Growing Interest in Quantum Computing
3. State-of-the-Art: Teaching Emerging Technologies
4. Analysis
5. Proposed Model
6. Conclusion
References
Teaching PSE Mastery During, and After, the COVID-19 Pandemic
Abstract
1. Introduction - typical instructional objectives for PSE mastery
2. Student-centered vs Teacher-centered teaching
3. On-line challenges and how to address them
4. A flipped roadmap for the future
5. Conclusions
References
Real-Time Chemical Process Monitoring with UMAP
Abstract
1. Introduction
2. Methods
3. Results
4. Conclusions
References
Efficient Energy Integration and Design of Distillation Separation Sequences
Abstract
1. Introduction
2. Algorithm for the efficient energy integration in thermally coupled distillation
3. Example
4. Conclusions
5. Acknowledgements
6. References
Enhancing operability during early stage of process synthesis considering flexibility and inherent safety simultaneously
Abstract
1. Introduction
2. Methodology
3. Case study
4. Conclusions
References

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31st European Symposium on Computer Aided Process Engineering

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