rocksalt
- sisl.geom.rocksalt(alat, atoms, orthogonal=False)
Two-element rocksalt lattice with 2 (non-orthogonal) or 8 atoms (orthogonal)
This is equivalent to the NaCl crystal structure (halite).
- Parameters:
alat () – lattice parameter
atoms (Atom) – a list of two atoms that the crystal consists of
orthogonal () – whether the lattice is orthogonal or not