Contributions
Digitalisation
Materials Modelling Marketplace for Increased Industrial Innovation
Dirk Helm
Fraunhofer IWM, Germany
IRES (Innovation in Research and Engineering Solutions)
Theodoros Efthymiadis
IRES, Belgium
The European project OYSTER and its Open Innovation Platform
Marco Sebastiani
University “Roma Tre”, Italy
Impact in Industry
HPC Performance Optimisation for Materials Science
Federico Panichi
Numerical Algorithms Group Ltd, UK
Industry-Leading Solutions for Atomic-Scale Modeling of Materials
Umberto Martinez
Synopsys QuantumATK, Denmark
Modelling Strategy at the Lightcode Project: an Ecosystem for Advanced Materials
Javier Gomez
Advanced Material Simulation, Spain
OntoTrans – Ontology driven Open Translation Environment
Gerhard Goldbeck
Goldbeck Consulting, UK
Tekniker – Modelling activities
Amaya Igartua
TEKNIKER, Spain
Interoperability
An ontology for physical metallurgy
Jesper Friis
SINTEF, Norway
BattINFO: The ontology for the Battery Interface Genome – Materials Acceleration Platform (BIG-MAP)
Tejs Vegge
Technical University of Denmark, DK
EMMO-python – working with EMMO in python
Francesca Bleken
SINTEF, Norway
MDO – An Ontology for the Materials Design Domain
Patrick Lambrix
Linköping University, Sweden
Ontology-driven data documentation for Industry Commons – OntoCommons
Nadja Adamovic
TU Wien, Austria
Ontology-based Nanosafety Assessment: The case of nano – enhanced polymers in 3D printing (FFF)
Theo Efthymiadis
IRES, Belgium
Predicting the properties of molecular materials: multiscale simulation workflows meet machine learning
Fabio Le Piane
CNR-ISMN, Italy
Model Development
A reversible coarse grained model for truly accurate multiscale simulations
Otello M Roscioni
MaterialX LTD United Kingdom
A Physics-guided Machine Learning Model Based on Peridynamics
Erkan Oterkus
University of Strathclyde UK
DAIMON Team – CNR-ISMN
Francesco Mercuri
CNR-ISMN, Italy
Development of digital materials for microstructure design: application to polymeric foams
Jean-Luc Bouvard
Mines ParisTech, France
Data-Led Structure Analysis of Simple and Multicomponent Carbides and Phase Nucleation
James Ren
Liverpool John Moores University, UK
New Modelling Approach for Edge Cracking Simulations
Ricardo Hernández Rossi
EURECAT Technology Centre, Spain
Multi-scale modeling of OLED devices
Fedor Goumans
SCM, the Netherlands
QWED Sp. z o.o.
Marzena Olszewska-Placha
QWED Sp. z o.o., Poland
Surface Free Energy Characterization of Soft Materials through Computational Experiments
Francesco M. Bellussi
Politecnico di Torino, Italy
Reshealience project – UHDC durability modelling: from material to structural level
Antonio Cibelli
Politecnico di Milano, Italy
The VECMA toolkit for uncertainty quantification
Wouter Edeling
CWI Amsterdam, Netherlands
Policy
EMMC ASBL – European Materials Modelling Council
Gerhard Goldbeck
EMMC ASBL, Belgium
TOWARDS A COMPETITIVE AND SUSTAINABLE NANOFABRICATION INDUSTRY
Stefano Galleno
RINA, Italy
Software
A journey through electronic structure and materials modelling at the exascale
Andrea Ferretti Daniele Varsano
CNR-NANO Italy
E-CAM, European Centre of Exellence
Ana C. Mendonça
CECAM, Switzerland
IM2D: an industry-driven interoperable solution for the simulation-aided design of emerging electronics
Arrigo Calzolari
CNR-NANO, Italy
TREX Targeting Real Chemical Accuracy at the Exascale
Michele Casula
TREX, The Netherlands
Towards a Microstructure Simulation Ecosystem
Georg J. Schmitz
MICRESS, Germany