purification_density_builder.h File Reference
#include "mpqc/chemistry/qc/lcao/scf/fwd.h"
#include "mpqc/math/external/tiledarray/device_tile.h"
#include <vector>
#include "mpqc/chemistry/qc/lcao/scf/density_builder.h"
#include "mpqc/math/external/tiledarray/dist_array_vector.h"
#include "mpqc/chemistry/qc/lcao/scf/purification_density_builder.ipp"
Include dependency graph for purification_density_builder.h:
This graph shows which files directly or indirectly include this file:
Classes | |
class | mpqc::lcao::PurificationDensityBuilder< Tile, Policy > |
Computes new density matrix and orbitals from a Fock matrix by purification. More... | |
Namespaces | |
mpqc | |
The top-level namespace for all Massively Parallel Quantum Chemistry package. | |
mpqc::lcao | |