Latest News

Tutorial: Li-Ion diffusion coefficients with ReaxFF

We have set up an advanced tutorial in which we discuss how to calculate Li-Ion diffusion coefficients with ReaxFF in (dense) materials both directly from a trajectory and by means of extrapolation from high temperatures....

Yale seminar: Chemistry & Materials with ADF

Come to the ADF seminar on December 1st at Yale to learn about new and planned developments in the ADF Modeling Suite. The seminar is hosted by Prof. Victor Batista at the Yale Chemistry Research Building...

Discuss your Materials Science challenges at MRS fall meeting

Whether you research nanoparticles, 2D electronics, organic electronics, photovoltaics, polymers or other materials, we love to hear about your challenges. Maybe we already have the right tools in our ADF Modeling Suite, or we can...

Discuss computational chemical engineering at WCCE10

Ole and Nick will represent SCM at the 10th World Congress of Chemical Engineering, held in Barcelona from 1-5 October. At the SCM booth at the Expoquimia (2-6 October) they will happily demo ReaxFF for studying...

Benchmark: density functionals and settings for band gaps

Jetsabel Figueroa, MSc. student in the OptoElectronics group at the TU Delft, benchmarked band gap calculations with BAND. During her internship with SCM she made use of the python scripting tool PLAMS (see the script with...

Developers Tomáš Trnka (ReaxFF) and Nick Austin (COSMO-RS) join SCM

The SCM team is very pleased to welcome Dr. Tomáš Trnka and Dr. Nick Austin per 1 September 2017, as Horizon 2020 SME innovation associates. Tomáš is finalizing his PhD in biomolecular chemistry with Prof....

Symposium in Honor of Roald Hoffmann

The Chemical Bonding and Reactivity Spanning the Periodic Table symposium celebrated Prof. Roald Hoffmann‘s 80th birthday. At the 254th ACS fall meeting in Washington DC around 75 collaborators, friends and academic offspring gathered to tell...

Materials Modeling Webinar

Materials Modeling with ADF 7 September, 2-3.30pm Indian Standard Time (10.30am-noon CEST) – Fedor Material properties are ultimately determined at the atomistic level. The ADF Modeling Suite provides a user-friendly, powerful set of computational chemistry...

ADF in Action at EUCO-TCC

Enjoy the beautiful courtyard at IEC during your coffee break at the 11EUCO-TCC? Why not have a chat with Ole at the SCM booth about your research at the SCM booth? Ole will happily demonstrate...

See ADF in action at the ACS Washington

The ACS fall meeting 2017 is held August 20-24 in Washington, DC. Come to booth 1110 at the expo to see ADF in action and discuss how ADF can aid your research projects! This is...