Highlights with ‘screening’

Additives & Modelling

The Dutch Association of Paint Technicians (NVVT) is organizing a focus session on additives and modelling on 23 January in Nieuwegein. Stan will give a 10-minute overview of how atomistic and continuum modeling can help...

How to run multiple PLAMS jobs through SLURM (video tip of the week)

In this video tip of the week, we’ll show how easy it is to run several PLAMS jobs through the SLURM queueing system, both on one and across several nodes. See also the PLAMS cookbook...

Discuss your materials discovery challenges at TechConnect World 19-21 June

At the TechConnect World meeting in Washington, Nicolas will discuss how to accelerate the computational design of materials and processes with machine learning, discussing applications for batteries, catalysis, and OLEDs. He’ll be happy to learn...

Accelerated Materials Innovation: TechConnect 15-17 November

At the TechConnect Europe meeting in Malmö, Fedor will present a technical talk as well as an innovation pitch on Accelerated Materials Innovation Through Machine-Learning Assisted Atomistic Modeling. By combining active learning with atomistic methods,...

In Silico Solvent Selection for Lignocellulosic Biomass Conversion

Renewable lignocellulosic biomass-derived platform chemicals, such as furfural and 5-hydroxymethylfurfural (HMF), offer promising pathways to tomorrow’s polymers, fine chemicals, and pharmaceuticals. High HMF yield from fructose dehydration in the aqueous phase is severely curtailed by...