[][src]Module bader::atoms

Contains Atoms for storing the relevant data on the atoms in the calculation. Also contains Lattice and ReducedLattice for storing information about the cell in which the density is stored.

Structs

Atoms

struct for containing the information about the atoms.

Lattice

Lattice - structure for containing information on the cell

ReducedLattice

Stores the lll-reduced lattice.