qimpy.grid

Grids, fields and their operations

Classes

Grid	Real and reciprocal space grids for a unit cell.
Field	Abstract base class for scalar/vector fields in real/reciprocal space.
FieldR	Real fields in real space.
FieldC	Complex fields in real space.
FieldH	Real fields in (half) reciprocal space.
FieldG	Complex fields in (full) reciprocal space.
FieldSymmetrizer	Space group symmetrization of reciprocal-space FieldH's.

Modules

coulomb

Coulomb interactions with support for partial periodicity