MaterialsAtlas App · MD / Atomistic Simulation
Surface Energy and Wetting Calculator
Generate a slab from a bulk structure, relax bulk/slab with MLIP, and estimate surface energy plus a first-pass wetting proxy.
About this app
Generate a slab from a bulk structure, relax bulk/slab with MLIP, and estimate surface energy plus a first-pass wetting proxy.
MaterialsAtlas apps are browser-based materials science tools for composition checks, structure analysis, screening, prediction, visualization, and research workflows.