32nd European Symposium on Computer Aided Process Engineering

T1: Modelling and Simulation

1 Periodic Oscillations in Methane Reactor: Effects of the Main Operating Parameters.

2 Modeling and Simulation of Non-Isothermal Ceramic Drying

3 Numerical study on the solid phase residence time distribution in a counter-current screw extractor

4 Dynamic modelling of light and temperature effects on biomass growth and biohydrogen production by the photosynthetic bacterium Rhodopseudomonas palustris.

5 Reducing the experimental effort to design pharmaceutical tablet lubrication by model-based design of experiments

6 A model-based approach to predict the flowability of directly compressed pharmaceutical blends from individual components

7 Purification of MIBA by Continuous Distillation

8 Modelling of Organophilic Pervaporation for Separation of Acetone-Butanol-Ethanol Mixture

9 Development of Deep Learning Architectures for Forecasting Distillation Columns Dynamic Behavior of Biobutanol Purification

10 Impact of Methanol Synthesis Kinetics on Bulk Production Prediction: an In-Silico Assessment

11 Optimal layout of modular multi-floor process plants using MILP

12 Paving the way to multi-case optimization of a Rankine cycle for cogeneration in nuclear power plants

13 Dynamic modelling of non-isothermal open-cell foam catalyst packings: selective sugar hydrogenation to sugar alcohols as a case study

14 Optimising a wind farm with energy storage considering curtailment and uncertainties

15 Optimisation of Biofuel and Kerosene Fuel Blends to Support Susainable Aviation

16 Dynamic Surrogate Modeling for Continuous Processes Control Applications

17 Probabilistic machine learning based soft-sensors for product quality prediction in batch processes

18 Property Estimation Method for Cannabinoids and Terpenes Using Machine Learning

19 Kinetic modelling of γ-linolenic acid production by Cunninghamella echinulata

20 Techno-economic and environmental analysis of pyrolysis process simulation for plastic (PET) waste

21 Monte Carlo Simulation of the Mechanical Processing of Bulk Materials with Fluctuating Compositions - Compositional Probability Density

22 Determination of the burst pressure of pillow plates using finite element methods

23 A hybrid multi effect distillation and double reverse osmosis system for most economical brackish water desalination

24 Computational intelligence applied to the mathematical modeling of enzymatic syntheses of biosurfactants

25 A Practical Guide to Coffee Roaster Modelling

26 Modeling and simulation of anoxic-aerobic algal-bacterial photobioreactor for nutrients removal

27 Gaussian-Process based inference of electrolyte decomposition reaction networks in Li-ion battery failure

28 Energy evaluation of processes for the production of hydrogen from biomass biodigestion under Aspen Plus

29 Life cycle optimization of energy systems integrated with carbon capture and utilization

30 A comparative study of swarm intelligence and artificial neural networks applications in modeling complex reaction processes

31 Combined optimization of start-up shut down and grade transition of a multistage continuous crystallization process

32 Systematic dynamic modelling of heat exchanger network

33 Technical and economic assessment of a castor bean biorefinery to produce renewable aviation fuel: a computer-aided design

34 SiCN fibers as advanced materials for electromagnetic shielding in X-band: experiments and computational modelling and simulation

35 Continuous-Time Surrogate Models for Data-Driven Dynamic Optimization

36 Parameter estimation in dynamic metabolic models applying a surrogate approximation

37 A Benchmark Model to Generate Batch Process Data for Machine Learning Testing and Comparison

38 Global warming impact of electric city buses in Chile: Critical stages of their fabrication and use

39 Optimizing Total Energy Consumption for Ammonia Production via Electrochemical Reaction and Haber-Bosch Process.

40 Optimization for sustainable hydrogen production path

41 Development of lactic acid evaporation process model with multi effect evaporator and mechanical vapor recompression system

42 Optimization-Based Framework for Robust Modeling and Design of Kinetic Systems

43 Optimal control system for products quality from a deethanizer column

44 Importance of detailed experimentation in the model based design and scale up of pharmaceutical spray dryers for heat sensitive products

45 Process modelling of Direct Air Capture (DAC) of CO2 using solid amine sorbents

46 Mechanistic modelling for thrips incidence in organic banana

47 A novel approach for the modelling of trickle bed reactors

48 Alkaline Water Electrolysis Prediction Model For Biopharmaceutical Products

49 Effect of air dynamics on the discharge of a pharmaceutical powder using the discrete element method

50 Biorefinery modelling is in tatters, and here is why

51 Simulation of a Fischer-Tropsch reactor for jet fuel production using Aspen Custom Modeler

52 Techno-economic-environmental analysis of a microbial oil production integrated into a bioethanol sugarcane biorefinery

53 Modeling the hydrodynamic sizing and rating of reactive packing in Aspen Plus

54 Simplified Model-based Design of Plate-fin Microdevices with Uniform Flow Distribution at High Flow Rates

55 CFD-based study of fluid flow and transport phenomena in fixed bed compact reactors

56 Multicomponent, nonisothermal VOC adsorption modelling for pharmaceutical effluent purification: Effect of operating conditions on bed performance

57 Hydrogen Separation via Continuous Hydrate Formation

58 Combined particle model and experimental approach for predicting pyrolysis with palm kernel shells

59 Methanation of CO2 byproduct from an ammonia plant with green hydrogen

60 Uncertainty analysis applied to distillation columns calculations

61 Gas diffusion channels in Li-O2 batteries: a comparison of wet and flooded electrodes

62 Techno-economic analysis of flexible AP-X LNG production process under risks and uncertainties

63 Modelling and Parameter Fitting of the Dosage of Hydrogen Peroxide in a Photo-Fenton Process

64 Performance optimization of condensate stabilization unit in LNG

65 Data-driven modelling of full batch distillation cycles based on recurrent neuronal networks

66 Stackelberg Game Design and Operation of a Non-Cooperative Bi-Level H2 Supply Chain Under Cournot Equilibrium

67 Modelling of Heat-Driven Water Treatment Systems: Multi-Effect Distillation (MED) model in Modelica

68 Continuous operation of a solar photobioreactor with linearizing control – A simulation study

69 Dynamic Inherent Safety Analysis of a Distillation Column under Simultaneous Design and Control

70 Modeling of phosphates slurry pipelines through dynamic non-Newtonian fluid model with Modelica

71 Techno-Economic Analysis of the Conversion of Waste Plastics to Hydrogen Fuel

72 Evaluating the flexible operation of vacuum pressure swing adsorption for CO2 capture from modern gas turbines

73 Exergoeconomic assessment of the optimized vapour-recompression assisted column for palm-based fatty acid fractionation

74 A Reduced Population Balance Model for Coupled Hydrodynamics and Mass Transfer in Shallow Bubble Column Reactors

75 Modeling of the crystallization of gypsum produced in the digestion tank of an industrial phosphoric acid manufacturing process

76 Development of a whole-body physiologically-based pharmacokinetic model for high-dose methotrexate

77 Analysis of an industrial adsorption process based on ammonia chemisorption: model validation

78 CFD modeling and simulation of an ammonia adsorption process

79 Polygeneration from sugarcane industries enhanced by functionalizing novel cultivars and excess thermal energy

80 Economic optimization of a reactive distillation column with multiple reactive sections for silane production

81 A multiscale model of proliferating and quiescent cell populations coupled with cell cycle dynamics

82 Multi-objective optimization of the food chain as a support for the development of the agricultural sector

83 Optimal CO2 allocation for enhanced oil recovery operations within carbon utilisation networks in Qatar

84 Optimal operation of a batch evaporator for the controlled production of titania nanoparticles

85 A model-based approach for predicting banana rust thrips incidence from atmospheric variables

86 Comparison between 3D numerical simulations and experimental results of a lab-scale liquid-solid fluidized bed

87 Non-process elements in kraft bleach plants: adsorption equilibrium aiming at reducing water consumption

88 Re-design and scheduling of dairy thermal treatment processes for continuous operation

89 Xflow modeling for investigation of fluid structure interaction of artificial reef : application to burial effect

90 Metamodeling of chemical engineering unit operations using Kriging and prediction error estimation

91 On the integration of process engineering with metabolomics for the production of muconic acid: the case for Saccharomyces Cerevisiae

92 Modelling and simulation of a residual lignocellulosic biomass pyrolysis pilot plant

93 TECHNO-ECONOMIC-ENVIRONMENTAL ANALYSIS OF BIODIESEL PRODUCTION BY MAGNETIC NANOPARTICLES CLEAS OF EVERSA® TRANSFORM

94 Numerical Analysis of Impellers Hydrodynamics Performance in a Bioreactor CSTR with SPH

95 Οn the use of embedded models and advanced analytics to model complex processes in the cement industry.

96 Aspen Plus® modeling approach of beechwood gasification in a fluidized bed reactor using biochar as bed material

97 Mathematical modeling of the diffusion-limited (DLA) aggregation accompanied by particles swarming in reactors

98 Verification of Neural Network Surrogates

T2: Product/Process Synthesis and Design

99 Promising future for biodiesel: Superstructure optimization from feed to fuel

100 Model-based solvent selection for the integrated synthesis, crystallisation and isolation of pharmaceutical compounds

101 Computer-aided solvent design for suppressing HCN generation in amino acid activation

102 Improving sustainable CHOSYN´s targets through process intensification

103 A novel process design for automated quality analysis in an integrated biopharmaceutical platform

104 A multiscale approach towards the use of urban waste within the energy transition strategy

105 Integration of thermo-chemical energy storage for flexible operation of decarbonized power plants

106 Superstructure optimization for sustainable design of an algae biorefinery

107 Economic and Environmental Optimization and Feedstock Plannig for the Renewable Jet Fuel Production Using an Intensified Process

108 Heat exchanger networks with different shell and tube configurations.

109 Considering Environmental and Social Impact in Optimization of a Supply Chain for Bio-Jet Fuel Production

110 Superstructure Optimization of Dimethyl Ether Process

111 A comprehensive evaluation on the COSMO-SAC-dsp model for vapor-liquid equilibrium predictions of refrigerants

112 Design and Evaluation Strategies for a Novel Hybrid Trigeneration System

113 Process synthesis for desalination using superstructure optimization on membrane technologies.

114 A comparison of process synthesis approaches for multistage separation processes by gas permeation

115 Bifurcation analysis of combined agglomeration and layering granulation in fluidized bed processes

116 Enhancement of energy saving of reverse osmosis system via incorporating a photovoltaic system

117 Design and simulation of methanol synthesis using heavy residues with carbon utilization

118 Integrated process synthesis and design of intensified/hybrid processes

119 Macroalgae-based integrated biorefinery for hydrocolloids, chemicals and advanced biofuels production

120 Design Space Determination of Mesenchymal Stem Cell Cultivation by Dynamic Modeling under Uncertainty

121 Deterministic global optimization of multistage layer melt crystallization using surrogate models and reduced space formulations

122 Model-Based Design Space for Protein A Chromatography Resin Selection

123 Sustainable Energy Systems Design with Heat Pump Technologies for Meeting Peak Heating Demand

124 Isopropanol/ n -Butanol/ ethanol separation from diluted fermentation broth by distillation. Process optimization using Mixed Integer Linear Programming (MILP) techniques.

125 Automatic synthesis of hybrid processes using distillation and liquid-liquid extraction for the separation of azeotropic mixtures

126 A framework for optimal and flexible schemes design under uncertainty & sustainable aspects

127 Optimization-based assessment framework for CO2 utilization to fuels strategies

128 A novel approach to continuous extraction of active ingredients from essential oils through combined chromatography

129 Digital design and optimization of an integrated reaction-crystallization-filtration continuous pharmaceutical process

130 Multi-objective optimization of natural gas liquefaction process simulation via kriging surrogate model

131 Integrated synthesis, modeling, and assessment of waste-to-resource alternatives

132 MINLP model for work and heat exchange networks synthesis considering unclassified streams

133 Planetary Boundaries Assessment of Flue Gas Valorization Into Ammonia and Methane

134 A techno-economic assessment of biochar production from date pits in the MENA region

135 Design of sustainable processes for CO2 capture

136 Water network optimisation in chemical complexes: a refinery case study

137 Optimal design of solar-aided hydrogen production process using molten salt with CO2 utilization for polypropylene carbonate production

138 Hierarchical Approach for Solvent Selection in Circular Economy

139 A Framework to Facilitate Decision Making for Infrastructure Options Analysis of Distribution and Utilities Systems in Chemical Production Plants

140 An Optimization Model for Expansion Planning of Reliable Power Generation Systems

141 Application of an ontology-based decision support system for the design of emulsion-based cosmetic products

142 Synthesis of extractive distillation structures for the purification of ethanol

143 Optimal design for flexible operation with multiple fluctuating input parameters

144 Design and Optimization of Membrane System for Gas Separation

145 Assessment of Carbon Capture Technologies for Waste to Energy

146 Process Integration and Techno-Economic Assessment of a Green Biorefinery Demonstration Scale Platform for Leaf Protein Production

147 The effect of alternative fuels on calcium looping

148 Simultaneous Synthesis of Metabolic and Process Engineering for the Production of Muconic Acid

149 Renewable hydrogen supply chain for transport application in Corsica island

T3: Large Scale Design and Planning/Scheduling

150 Optimal configuration of a biodiesel production network using oil from black soldier fly larvae

151 Optimization of Sink Locations in Carbon Integration Networks

152 Towards Efficient Bioenergy Systems: Understanding the Role of Soil Sequestration, Supply Chain Design, and Carbon Capture

153 A Multi-Period Planning and Scheduling Strategy for Developing Hydrogen-Based Supply Chains

154 Holistic Capacity Management and Production Planning in the Pharmaceutical Supply Chain

155 Towards Resilience in Design and Operation of Next-Generation Vaccines and Therapeutics Supply Chains

156 Network-Based Analysis of Electrified Chemical Processing with Renewable Energy Sources

157 MINLP framework for systems analysis of the chemical manufacturing industry using network models

158 A Novel Approach for Vehicle Fleet Sizing and Allocation Under Uncertain Demand

159 Fresh vs frozen: assessing the impact of cryopreservation in personalised medicine

160 A novel hybrid algorithm for scheduling multipurpose batch plants

161 Assessment of biomass supply chain design and planning using discrete-event simulation modeling

162 Design of a three-echelon supply chain under uncertainty in demand and CO2 allowance prices

163 From simulation towards optimisation for petroleum refinery operations in industry 4.0

164 Decomposition of Two-stage Stochastic Scheduling Problems via Similarity Index

165 A New MILP Formulation for Scheduling of Crude Oil Operations

166 Multiperiod optimization model for CO2 capture, storage and utilization, Colombian case study

167 Towards improved rescheduling operations: small time-steps and long time-horizon

168 "Pharmaceutical industry supply chains: planning vaccines’ distribution"

T4: On Line Model Based Applications and Control

169 Plantwide control strategy for a biodiesel production process from Jatropha curcas oil with variable composition

170 Cascade fuzzy control of a tubular chemical reactor

171 Design and Implementation of an Optimal Control Framework for Post-combustion CO2 Capture Process

172 Data Driven Process Monitoring, from Fault Detection and Diagnosis Points of View, in Industry 4.0 Context

173 Safe Reinforcement Learning for Batch Process Control and Optimization

174 Support Vector Machine-based Design of Multi-model Inferential Sensors

175 Model predictive control for greenhouse condition adjustment and crop production prediction

176 Study on the noise contents in industrial measurements and their impact on process monitoring

177 A Comparative Study on the Influence of Different Prediction Models on the Performance of Residual-based Monitoring Methods

178 Optimal operation of parallel mini-bioreactors in bioprocess development using Multi-Stage MPC

179 Platform for online system identification and diagnosis of dynamic ultrafiltration systems

180 Development of a virtual sensor for real-time prediction of granule flow properties

181 A Hierarchical Approach to Monitoring Control Performance and Plant-Model Mismatch

182 Optimal Control Policies of a Crystallization Process Using Inverse Reinforcement Learning

183 Dynamic Real-Time Optimization with Closed-Loop Prediction for Nonlinear MPC-Controlled Plants

184 Dynamic Real-Time Optimization of a Solar Thermal Plant during Daytime

185 Online Bayesian Re-design of Parallel Experiments based on Asynchronous Posterior Sampling

186 Dynamic optimisation and comparative analysis of fed-batch and perfusion bioreactor performance for monoclonal antibody (mAb) manufacturing

187 Control of an industrial packed extraction column for biodiesel washing

188 Development of mechanistic reduced order models (ROMs) for NMPC control applications in continuous manufacturing of pharmaceutical solid-dosage forms

189 Health-aware control using hybrid models applied to a gas-lifted oil well network

190 Applying Ecological Interface Design for Modular Plants: Safety-Demonstrator Case Study

191 Path-following for parametric MPCC: a flash tank case study

192 Feature engineering for neural network-based oscillation detection in process industries

193 Multiparametric Model Predictive Control Strategies for Evaporation Processes in Pharmaceutical Industries

194 Process as a battery: Electricity price based optimal operation of zeolite crystallization in a COBR

195 Leveraging Deep Learning for Efficient Explicit MPC of High-Dimensional and Highly Non-linear Chemical Processes

196 Incorporation of error propagation into an elemental balancing based soft-sensor for improved online monitoring of microbial fed-batch processes

197 In-silico Formulation of Iterative Learning Control for Chromatographic Purification of Biopharmaceuticals

198 Application of Real-Time Optimization with Modifier Adaptation to the Reactive Extrusion of Hydrophobically Modified Ethoxylated Urethanes

T5: Concepts, Methods and Tools

199 Development of a virtual platform for the metaheuristic optimization of heat exchangers

200 Combining optimization and life cycle assessment: Design of low-carbon multi-energy systems in the SecMOD framework

201 Robust Design of Distributed Energy Systems Within Unbalanced Power Networks

202 SCR: A novel surrogate- based global optimization algorithm for constrained black-box problems

203 Comparative Life Cycle Assessment of Demand-Side Management via Operational Optimization

204 A rigorous synthesis and optimal design methodology for chemical and biochemical processes

205 Renewables-Based Multigeneration System for District Energy Supply

206 Topology-Based Construction of Business-Integrated Material Modelling Workflows

207 Investigation of optimal blending of livestock manures to produce biocrude via hydrothermal liquefaction

208 Systematic Pairing Selection for Economic-oriented Constraint Control Structure

209 Quality assessment for dynamic, hybrid semi-parametric state observers

210 ANN-assisted optimization-based design of energy-integrated distillation processes

211 Application of multiplicative homomorphic encryption in process industries

212 PPOPT - Multiparametric Solver for Explicit MPC

213 Improved Sequential Least Squares Programming–Driven Feasible Path Algorithm for Process Optimisation

214 Parallel Simulated Annealing approach for optimal process plants instrumentation

215 A sparse polynomial surrogate model for the shrinking core model in phosphate ore digestion

216 On the use of data engineering and machine learning in global optimization applications with cutting plane approximations

217 A systematic approach for the processing of experimental data from anaerobic syngas fermentations

218 Process Systems Engineering prospects in Circular Economy implementation in industry

219 Incremental financial analysis of black liquor upgraded gasification in integrated kraft pulp and ammonia production plants under uncertainty of the feedstock costs and carbon taxes

220 A Capex Opex Simultaneous Robust Optimizer: Process Simulation-based Generalized Framework for Reliable Economic Estimations

221 A soybean supply chain model to analyze the greenhouse gas emissions of the transport sector

222 Ontology for Enhanced Industrial Process Control

223 Complementing Natural Gas Driven Syngas with Optimum Blends of Gasified Biomass Waste

224 How tools and technologies can help drive sustainability

225 The use of game theory in the analysis of oil and marine lubricant markets in ports

T6: Digitalization and Artificial Intelligence

226 Application of outlier treatment towards improved property prediction

227 Data-driven, image-based flow regime classification for stirred aerated tanks

228 Data-driven modeling for physical property prediction of polypropylene composites using artificial neural network and principal component analysis

229 Optimization of the Wastewater Treatment Plant Aeration Using Artificial Neural Networks Models

230 The truncated Q statistic for Statistical Process Monitoring of High-Dimensional Systems

231 Development of a predictive emission measurement system using hybrid models with real industrial data

232 On The Interpretability of Graph Neural Network in QSPR modeling

233 Predictive Maintenance in the Digital Era

234 An evolutionary approach for techno-economic assessment

235 Optimization of an artificial neural network structure for modeling carbon capture in spray columns

236 Hierarchical Statistical Process Monitoring based on a Functional Decomposition of the Causal Network

237 A Recurrent Neural Networks-Based Approach for Modeling and Control of a Crystallization Process

238 Lithium-air battery electrocatalyst identification using Machine Learning and SciBERT word embeddings

239 A digital twin-concept for smart process equipment assemblies supporting process validation in modular plants

240 Bayesian Optimization for techno-economic analysis of pressure swing adsorption processes

241 Online state of charge estimation of lithium-ion battery using surrogate model based on electrochemical model

242 Machine-learning based prediction of infinite-dilution activity coefficients of ionic liquids using physiochemical properties

243 The Impact of Reward Shaping in Reinforcement Learning for Agent-based Microgrid Control

244 Knowledge mining from scientific literature for acute aquatic toxicity: classification for hybrid predictive modelling

245 Machine Learning for the prediction of the thermochemical properties (enthalpy and entropy of formation) of a molecule from its molecular descriptors

246 A Novel Machine Learning-Based Optimization Approach for the Molecular Design of Solvents

247 A methodology for gray-box modeling of nonlinear ODE systems

248 Optimal aeration of wastewater treatment plants based on recurrent neural networks and real plant data

249 Soft Sensor of Key Components in Recirculating Aquaculture Systems, using Feedforward Neural Networks

250 Interpretability of neural networks predictions using Accumulated Local Effects (ALE) and sensitivity measures.

251 Hybrid AI Models in Chemical Engineering – A Purpose-driven Perspective

252 A data driven model for prediction of adsorption energies on metallic surfaces

253 Probabilistic graphical models for the identification and analysis of reaction pathways in water treatment

254 Integrating autoencoder and heteroscedastic noise neural networks for industrial data analysis and soft-sensor design

255 Economic risk analysis of emergent green hydrogen facilities – A Monte Carlo approach

256 Machine Learning-Based Surrogate Models and Transfer Learning for Derivative Free Optimization of HTPEM Fuel Cells

257 A Methodology for The Optimal Surrogate Modelling of Digital Twins Using Machine Learning

258 Bayesian Neural Network-Based Calibration for Urban Air Quality Sensors

259 Hyperconic Machine Learning to Predict Microbial Growth

T7: CAPE Applications Addressing Societal Challenges

260 Optimal Contract Selection for Contract Manufacturing Organisations in the Pharmaceutical Industry Under Uncertainty

261 A framework for economic optimization of carbon capture and sequestration from Italian industrial sources under seismic risk constraints

262 Energy-water Scheduling Decisions for Agricultural Scenario Planning

263 Optimizing the allocation of resources for the security of the water-energy-food nexus

264 Application of CAPE Tools into Prospective Life Cycle Assessment: A Case Study in Recycling Systems Design of Lithium-Ion Battery

265 A Fair-Sustainable Approach for the Optimization of an Integrated Fuel Production System

266 The advancement of zero-emission natural gas power plants and their role in future energy supply

267 Optimal Decarbonisation Policymaking Software Inspired by Process Integration

268 Interplaying of industry 4.0 and circular economy in cyber-physical systems towards the mines of the future

269 Environmental Impacts of Rice Husk-Derived Silica under Uncertainty: Is ”Bio” better?

270 Economic analysis of novel pathways for recovery of lithium battery waste

271 Assessment of the Techno-Economic and Sustainability Potential of Engineered Cell Factories in a Xylitol Biorefinery

272 Optimal design and planning of supply chains for viral vectors and RNA vaccines

273 Different approaches to epidemic modeling - The Covid-19 case study

274 An integrated and sustainable Ethanol-Hydrogen-Ammonia-Urea plant.

275 A methodology based on social life cycle assessment for social hotspots identification

276 A game-theoretical approach for the analysis of waste treatment and circular economy networks

T8: Education in CAPE and Knowledge Transfer

277 Agile Process Systems Engineering (PSE) education – 1. What should be taught to achieve desired outcomes mastery by graduates?

278 You have nothing to lose: Worry-free flipping for PSE

279 Agile Process Systems Engineering (PSE) education – 2. How to teach to achieve desired outcomes mastery by graduates?

280 Modelling and optimisation decision-making for improved educational resilience under pandemic events

281 Teaching courses heavily dependent on computational resources to STEM students during Pandemic