ChemistryAtlas App · Molecular 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.
ChemistryAtlas apps are browser-based chemistry discovery tools for structure drawing, compound identity, reaction planning, spectroscopy, safety, cheminformatics, visualization, screening, and research workflows.