Page 26 - ESCAPE PROGRAMME

RD EUROPEAN SYMPOSIUM ON COMPUTER-AIDED PROCESS ENGINEERING
08:00 – 09:00
REGISTRATIONS
09:00 – 10:00
10:00 – 10:20 10:20 – 12:30
COFFEE BREAK
TUESDAY, JUNE 20, 2023
18-21 JUNE 2023
ATHENS-GREECE
Olympia Hall
Olympia Foyer & Kallirhoe Room
PLENARY SESSION 3
Chairs: Prof. Stratos Pistikopoulos, Prof. Robin Smith
Strategies and Tools for Optimization-Driven Modeling: A New Era for CAPE
Prof. Lorenz Biegler, Covestro University Professor, Carnegie Mellon University
Olympia Hall
SESSION S3-01: Properties αnd Materials (I)
Track 1
774
Academic and Industrial Views on the Future of Applied Thermodynamics
119
217
302
Georgios M. Kontogeorgis1, Jean-Charles de Hemptinne2, Ralf Dohrn3, Ioannis G. Economou4, Antoon ten Kate5, Susanna Kuitunen6, Miranda Mooijer7, Ljudmila Fele Žilnik8, Maria Grazia De Angelis9, Velisa Vesovic10
1 Center for Energy Resources Engineering (CERE), Department of Chemical and Biochemical Engineering,
Technical University of Denmark, DK-2800, Lyngby, Denmark
2 IFP Energies nouvelles, 1 et 4, avenue de Bois-Préau,92852 Rueil-Malmaison Cedex, France
3 Bayer AG, Process Technologies, Building E41, 51368 Leverkusen, Germany
4 Texas A&M University at Qatar, Chemical Engineering Program, PO Box 23874, Doha, Qatar
5 Nouryon, Zutphenseweg 10, 7418 AJ Deventer,The Netherlands
6 Neste Engineering Solutions Oy, PO Box 310, FI-06101 Porvoo, Finland
7 Shell Global Solutions, Shell Technology Centre Amsterdam, Grasweg 3, 1031 HW Amsterdam, The Netherlands
8 Department of Catalysis and Chemical Reaction Engineering, National Institute of Chemistry, Ljubljana, Slovenia
9 Institute for Materials and Processes, School of Engineering, University of Edinburgh, Edinburgh, UK
10 Department of Earth Science and Engineering, Imperial College London, UK
Intelligent Process Flowsheet Synthesis and Design using Extended SFILES Representation
Vipul Manna, Rafiqul Ganib,c, Venkat Venkatasubramaniana
a Columbia University, New York, NY 10027, USA
b PSE for SPEED Company, Charlottenlund, DK-2920, Denmark
c Sustainable Energy and Environment Thrust, The Hong Kong University of Science and Technology (Guangzhou),
Guangzhou, China
Connectivity Matrix-based Descriptors with Deep Learning for Estimation of Pure Component Properties
Qiong Pana, Xiaolei Fanb, Jie Lia
a Centre for Process Integration, Department of Chemical Engineering, School of Engineering, The University of
Manchester, Manchester M13 9PL, UK
b Department of Chemical Engineering, School of Engineering, The University of Manchester, Manchester M13 9PL, UK
S-GNN: State-Dependent Graph Neural Networks for Functional Molecular Properties
Adem R.N. Aouichaoui, Alessandro Cogliati, Jens Abildskov, Gürkan Sin
Process and Systems Engineering Centre (PROSYS), Department of Chemical and Biochemical Engineering, Technical University of Denmark, Søltofts Plads, Building 228A, 2800 Kgs. Lyngby, Denmark
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