Following the spring and fall AMS2022 webinars (see also the AMS2022 webinar playlist), we are organizing a new series of webinars this spring with experts on a range of different topics presenting theory, relevant applications,...
Latest News
Geometry optimizations under stress: Graphite to Diamond phase transition (video tip of the week)
In this video tip of the week Ole shows how to simulate the phase transition from graphite to diamond by optimizing the geometry under a non-uniform external stress tensor. The guI input file for the...
19 June 2023: 1-day AMS workshop in Glasgow
As part of the Scottish Computational Chemistry Symposium 2023, we’ll organize a hands-on workshop at the University of Glasgow on 19 June. You will learn hands on how to use the Amsterdam Modeling Suite with...
Webinar 3: Excitation energy calculations with (nearly) exact Kohn-Sham potentials
Join our next FREE webinar in our Spring Webinar series 2023 with SCM’s founder Professor Evert Jan Baerends! This is a unique opportunity to deepen your knowledge about computational chemistry and some of the theory...
Multiscale Modelling of Transition Metal Carbides
This week SCM is hosting Hector Prats from Stamatakis Research Group at University College London! He is involved in the ReaxPro project and is visiting us to learn and explore all the tools included in...
Fast and accurate prediction of Kevlar’s mechanical properties via ANI-2X Machine Learning Potential (video tip of the week)
In this video tip of the week Ole shows how to use the ANI-2x machine learning potential to calculate the Elastic Tensor and mechanical properties of Kevlar. The input file for the calculation is available...
Chemistry automation by Evgeny Pidko
Last week Professor Evgeny Pidko visited SCM! He talked about the research they are doing on Chemistry automation in the Inorganic Systems Engineering (ISE) Group at TU Delft. One of their goals is the integration...
Discovering the uniqueness of hydrogen bonding with the Energy Decomposition Analysis
Join our next FREE webinar in our Spring Webinar series 2023 to learn about the Energy Decomposition Method (EDA) and its applications (EDA tutorial). Next Wednesday, May 24th, 2023, 15:00 CEST, with Professor Célia Fonseca...
How to use the replay task (video tip of the week)
In this video tip of the week we take a look at the AMS replay task. The AMS replay task allows you to play back a simulation with a different engine, updating all properties while...
AMS2023 New Release Webinar
Register for our FREE AMS2023 Released: New features Webinar! Learn about: Next Wednesday, May 17th, 2023, 15:00 CEST, with our Product Manager Matti Hellström. Register at: https://attendee.gotowebinar.com/register/4341128523549974617 Or subscribe below to get a personal invitation...