Build Module

The build module provides the core functionality for constructing atomistic systems from scratch. It acts as a high-level interface to generate crystalline surfaces, aqueous solutions, and complex interfaces suitable for LAMMPS simulations.

Builders

Advanced builders for creating and modifying complex structures.

cemd.build.SolutionBuilder	Blueprint for creating a solution.
cemd.build.SurfaceBuilder	Builder for generating surfaces.
cemd.build.Splitter	Split a system along an axis and optionally add a solution.
cemd.build.GlassBuilder	Blueprint for creating a glass structure.
cemd.build.CSHBuilder	Builder for creating C-S-H (Calcium-Silicate-Hydrate) structures.
cemd.build.AFBuilder	Builder for creating AFt (Ettringite) or AFm structures.