Upcoming Webinar: Machine-Learned Potentials: Surpassing the Limits of the Ab Initio World without Leaving it Behind

We are pleased to announce that the Materials Design MedeA User Group Meeting (UGM) will take place in the beautiful city of Vienna,...

Fundamentals of Crystalline Evolution and Properties of Carbon Nanotube-Reinforced Polyether Ether Ketone Nanocomposites in Fused...

Materials Design Announces the Release of MedeA 3.7, Material Performance! Materials Design announces the release of MedeA 3.7 the latest...

Volumetric and Energetic Properties of Polystyrene and Polyethylene Oxide Affected by Thermal Cycling ​ B Minisini; A Soldera (Materials...

Energetic and Structural Characterizations of the PET–Water Interface as a Key Step in Understanding Its Depolymerization ​ P. Fayon et...

A Multi-scale Computational Framework for Property Prediction of Fluid Mixtures Leveraging limited experimental data through simulation...

Please join University of Washington Professor Bruce Eichinger and Materials Design Chief Scientific Officer Dr. Erich Wimmer for an...

MedeA in Publication: Influence of Quantum Oscillations in the Thermal Scattering Law of Zirconium Carbide on Neutron Thermalization and Cri

A recent report details the extraordinary work carried out at the Idaho National Laboratory (INL) High Performance Computing (HPC)...

Materials Design’s State-of-the-Art Tools Supporting Tomorrow’s Energy Solutions: Controlled Fusion

New MedeA Application Note Because of its stability, corrosion resistance, and high strength-to-weight ratio titanium is of great...

Best Wishes for a happy and safe holiday season and a prosperous new year!

MedeA 3.6 - highly integrated machine learning methods that extend 'ab initio' accuracy to mesoscale system sizes and time scales...battery

Dr. Benoit Minisini presents a keynote talk at the conference “Matériaux 2022” Materials Design research scientist Dr. Benoit Minisini...

Here is a seasonally colored iso-contour through the electrostatic potential of a single Hydrogen Fluoride (HF) molecule, as calculated...

UGM Plenary Speaker Spotlight Tuesday, we host Dr. Jozef Bicerano; founder and President of Bicerano & Associates Consulting, LLC, USA...

UGM Plenary Speaker Spotlight Tuesday, we host Dr. Carla Verdi; Faculty at University of Vienna, Austria and Dr. Georg Kresse; Professor...

UGM MedeA Training Generating and Applying Machine-Learned Potentials with MedeA Instructor: Dr. David Reith Density functional theory...

UGM Plenary Speaker Spotlight This week, we host Jörg Behler; Full Professor of Theoretical Chemistry University of Göttingen, Germany...