The study explores the use of tantalum (Ta) doping to improve the performance and stability of LiNi0.80Mn0.1Co0.1O2 (NMC811) cathode mate...

MedeA VASP makes it easy to analyze and understand chemical bonding. By leveraging the integrated MedeA Environment you can quantify the...

At-a-Glance: MedeA Flowcharts make it easy to design and conduct systematic computational materials science studies with a visual...

MedeA 3.10 offers an integrated suite of multiscale modeling capabilities with advanced features that empower researchers to explore and des

Upcoming MedeA VASP Training Materials Design announces an online training session featuring MedeA, the industry-leading atomistic...

Materials Design presents an interview with a pioneer in computational materials design: Prof. Gregory B. Olson

MedeA VASP Training: Experience the ease with which atomistic models may be constructed and VASP simulations may be launched, monitored, and

Accelerating Materials Innovation: Connecting Quantum Simulations, Machine Learning, and Mesoscale Modeling to Speed Up Materials Research

Webinar: From the Femtoscale to the Mesoscale and Back: An Integrated Multiscale Approach #engineering #compchem

The partnership will connect MedeA Environment outputs to ICMD® models to provide common clients with the most accurate predictive and presc

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

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...

Jeffrey Grossman; Department Head of Materials Science and Engineering at the Massachusetts Institute of Technology

Radionuclide Sequestration in MOFs: DFT Method Exploration and a Conceptualization of Graph Neural Networks This webinar will be focused...