Basics The program generates various ice lattice with proton disorder and without defect. The total dipole moment is always set to zero (except in the case you specify--depoloption). The minimal structure (with --rep 1 1 1 option) is not always the unit cell of the lattice because it ...
GenIce is a modular program; it reads a unit cell data from a lattice plugin defined in the lattices folder, put water and guest molecules using a molecule plugin defined in the molecules/ folder, and output in various formats using a format plugin defined in the formats/ folder. You can ...