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

ParAMS ReaxFF parametrization challenge

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

Hands-on workshop virtual winter school on computational chemistry, 24 February

Reactive Grand-Canonical Monte Carlo Simulations for Modeling Hydration of MgCl2

New video: electron transport with eReaxFF

Thermal and mechanical properties of Ni-Cr alloys with ReaxFF

ReaxFF videos on polymer properties: CTE, Tg

Reversing fatigue in carbon-fiber reinforced vitrimer composites

Advanced ReaxFF workshop