activity
20082026
most citedSchNet - a deep learning architecture for molecules and materials

2.3k citations · 16.8k across the 81 of their papers we have counts for

collaborators
Showing 2026Show all

1 paper · 1 filter

cond-mat.mtrl-sci2026

Performance of Tkatchenko-Scheffler Dispersion Method with Updated van der Waals Radii: Importance for Alkali-Containing Systems

Aaron M. Schankler, Ruyi Song, Sampreeti Bhattacharya +5

The Tkatchenko-Scheffler (TS) pairwise method to calculate dispersion interactions is a widely used approach to incorporate missing long-range van der Waals contributions in semilo…