Recorded Webinars
In addition to regularly hosting live webinars, our past webinars are recorded so that you may refer to them at any time. Learn from our engaging scientists, enhance your experience using Materials Design, Inc. software, and download our slides!
The Open Catalyst Project
Join Abhishek Das and Anuroop Sriram of Facebook AI Research (FAIR)
Atomistic-scale simulations of realistic, complex, reactive materials: the ReaxFF reactive force field and its industrial and academic applications
Presented by Professor Adri van Duin
Materials Constitution Data in MSI Eureka – Fundamentals for Efficient R&D
Presented by Dr. Svitlana Iljenko, of MSI
Ab Initio for Millions - the Power of Machine-learned Potentials
Presented by Erich Wimmer, Volker Eyert, and David Reith
MedeA Training: MedeA Machine Learning Potential Generator (MLPG)
Presented by Dr. David Reith
Medea Training: MedeA VASP and Battery Applications
Presented by Dr. René Windiks
Post-DFT Accuracy for Finite Temperature Properties Using Incremental Machine Learning
Presented by Professor Georg Kresse
UGM 2021 Interview with Professor Chris Van de Walle
Presenters Chris Van de Walle and Erich Wimmer
UGM 2021 Training 01 Classical Forcefield-based Methods
Presented by Marianna Yiannourakou and Jörg-Rutiger Hill
Catalytic Processes for Sustainable Chemicals and Fuels
Professor Sir Richard Catlow
Molecular Simulations for Improved Process Modeling of an Acid Gas Removal Unit
Presented by Dr. Marianna Yiannourakou and Dr. Xavier Rozanska
The Innovative Force of High-Performance Computing in Materials Science
Presented by Erich Wimmer, Evan Weinberg, and Stefan Maintz
Calculs à Haut Débit dans l’Environnement Logiciel MedeA
Presented by Dr. Xavier Rozanska
Advancing Automotive Innovation with Materials Modeling
Industry Speaker: Dr. Jonathan Mueller, Volkswagen AG
Training: MedeA VASP: Explore the comprehensible and user-friendly GUI in MedeA VASP
Training with Q&A presented by Dr. David Reith
Development of New Solvents for CO2 Capture Using Molecular Simulations
Speaker: Dr. Frederick de Meyer, Total S.E.
Training-Advanced Atomic Model Building Based on Comprehensive Databases
Presented by Dr. Frédérick de Meyer, Total S.E. and Dr. Erich Wimmer, Materials Design, Inc.
Materials Constitution Data in MSI Eureka – Fundamentals for Efficient R&D
Presented by Dr. Svitlana Iljenko and Dr. René Windiks
Machine Learning Meets Quantum Chemistry: Using Theory, Data, and Experiments to Design Catalysts
Presented by Dr. Siwen Wang
Training: Orbital Level Understanding of Adsorbate-Surface Interactions in Catalysis
Presented by Dr. Siwen Wang
Training-Li-Ion Batteries and Beyond: Driving Next-Generation Energy Storage with MedeA
Presented by Dr. Taylor Juran
Li-Ion Batteries and Beyond: Driving Next-Generation Energy Storage with MedeA
Presented by Dr. Taylor Juran
Molecular Simulation of Fluids: The SAFT Coarse Graining Technique
Presented by Prof. Erich , Imperial College London
Computational Pharmaceutical Science: Guiding Experiments in a Sea of Variables
Presented by Dr. Kevin Gagnon, Senior Scientist at Vertex Pharmaceuticals Inc.
Modelling Catalyst Deactivation: Multiscale Modelling of Zeolite Catalysis
Presented by Professor Rutger A. van Santen, Full Professor Emeritus, Eindhoven University of Technology
The Random Phase Approximation: A Practical Method Beyond DFT
Presented by Professor Georg Kresse
Interatomic Potentials - Why We Still Need Them and How Can We Improve Them
Presented by Professor Richard Catlow FRS
From National Security to Energy Security: How Computational Chemistry is Defining Science at SRNL
Presented by Dr. Lindsay Roy of Savannah River National Laboratory
MedeA 3.1-- Precision at Scale -The New Normal
Presented by Dr. Marianna Yiannourakou, Dr. Jörg-Rüdiger Hill, and Dr. Walter Wolf
Exploring Battery Materials: Electrodes, Electrolytes, and Interfaces Thereof
Presented by Dr. René Windiks
VASP.6: Total energies beyond DFT
Presented by Dr. Martijn Marsman, senior scientist at the University of Vienna and VASP Software GmbH
Diffusion and You: Batteries, Catalysis, Alloys, Corrosion, and the Stock Market
Presented by Dr. Erich Wimmer and Dr. Benoit Minisini
Elasticity and Beyond: Predicting Mechanical Properties with MedeA
Presented by Dr. Ray Shan
High Value from High Throughput
in the MedeA Environment Replay
Presented by Dr. Clive Freeman
VASP in MedeA: A Fast Way- From Models to Reliable Results
Presented by Dr. Walter Wolf
Modeling Hydrogen in Metals: Diffusion, Dislocations, Phase Transformations, and Embrittlement
Presented by Dr. Erich Wimmer and Dr. Mikael Christensen
MedeA 3.0 Getting to Science Faster
Presented by Marianna Yiannourakou, Clive Freeman, René Windiks, and Volker Eyert
Use of Polymer Theoretical Concepts in Atomistic Polymer Simulation Software
Presented by Dr. David Rigby
Thermodynamic Properties of Multifunctional Polycyclic Compounds from Simulation
Presented by Dr. Philippe Ungerer
MedeA Deposition: Atomistic-Scale Simulations of Deposition, Growth, Oxidation, and Etching at your Fingertips
Presented by Dr. Ray Shan
The Color of Materials: Value from Computed Optical Properties
Presented by Dr. Erich Wimmer and Dr. Volker Eyert
Computational Analysis of Organic Photovoltaics and Organic Radical Batteries
Presented by Dr. Travis Kemper
Developing and Applying Correlative Models in Materials Science
Presented by Dr. Clive Freeman and Dr. Marianna Yiannourakou
Using MedeA to Study Formation and Properties of Polymer Networks
Presented by Dr. David Rigby
Predicting Petroleum Fraction Thermophysical Properties - Advances in Molecular Simulation
Presented by Dr. Marianna Yiannourakou
High Value from High Throughput in the MedeA Environment
Presented by Erich Wimmer and Clive Freeman
Atomistic-Scale Simulations of Real, Messy, Nasty, and Complex Reactive Materials – The ReaxFF Reactive Force Field and Its Applications
Presented by Professor Adri van Duin from Pennsylvania State University and Dr. Ray Shan from Materials Design
Predicting Elastic Properties Using Ab Initio And Forcefield Based Simulations
Presented by Dr. David Rigby and Dr. Walter Wolf
Advancing the Design of Materials for Batteries Through Atomic-Scale Modeling
Presented by Dr. René Windiks
