Latest News

The ReaxFF parametrization challenge (video tip of the week)

In this 8th video tip of the week, Ole introduces the ParAMS ReaxFF parametrization challenge. Take a look at the release notes of AMS2022 and the new ParAMS tutorials to see how ParAMS can help...

AMS2022 Released: Easier Parametrization ReaxFF & DFTB, reaction mapping, OLED tools

The SCM team proudly announce our new AMS2022 release, with many new features and improvements. The new ParAMS parametrization toolkit, including graphical interface, will make it easier for you to develop new or improve existing...

Accurate ionization potentials and electron affinities with qsGW (video tip of the week)

In this seventh video tip of the week, Ole showcases how to use the new qsGW code in ADF to accurately predict ionization energies without the need to search for a suitable functional. The video...

ParAMS ReaxFF parametrization challenge

What: Fit a ReaxFF force field using the new ParAMS module of AMS2022. Prizes:1st prize: 300 Euro discount on the next AMS license fee + 250 Euro Amazon voucher or equivalent2nd prize: 200 Euro discount...

Solvent optimization (video tip of the week)

In this sixth video tip of the week, Ole showcases how to optimize a solvent or solvent system for an EHS compliant liquid-liquid extraction. The video is a GUI version of the solvent optimization tutorial...

Li-Ion diffusion coefficients (video tip of the week)

In this fifth video tip of the week, Ole presents a new and much improved way to calculate diffusion coefficients from molecular dynamics trajectories with AMS2022. Tutorials: Li ion diffusion coefficients, Li ion discharge profile

Workshop Series: Using the Amsterdam Modeling Suite in HPC Systems, 16-29 March

The organization SURF is hosting a training course comprising four different afternoon sessions on March 16, 21, 23, and 29. After an overview of the Amsterdam Modeling Suite, its basic usage will be demonstrated in...

Three AMS GUI tips: changing units, exporting data, visualizing regions (video tip of the week)

In this fourth video tip of the week, Ole shares some of his favorite AMS GUI shortcuts with you: How to change the input units with a click, export data from the GUI and visualize...

Quick thermodynamic properties with COSMO-RS (video tip of the week)

In Ole’s 3rd tip of the week video, learn how to easily and quickly calculate thermodynamic properties of fluids with COSMO-RS, using vapor pressures of a mixture as an example. Our COSMO-RS module includes a...

Tackling exciton quenching to increase OLED efficiency: SEQUOIA project

To improve OLED lifetime and efficiency, researchers from the TU/e, VU, SCM, Simbeyond, and Merck join forces to reduce exciton quenching processes. The NWO-funded SEQUOIA project is led by Prof. Peter Bobbert of the TU/e...