ergo
densfromf Directory Reference

Files

file  densfromf_full.cc
 

Routine get_dens_from_fock_full() for getting density matrix from a given Fock matrix using diagonalization.


file  densfromf_full.h [code]
file  densfromf_general.cc
 

Routine get_dens_from_fock_general() for getting density matrix from a given Fock matrix.


file  densfromf_general.h [code]
file  densfromf_sparse.cc
 

Routine get_dens_from_fock_sparse() for getting density matrix from a given Fock matrix using purification.


file  densfromf_sparse.h [code]
file  simple_purification.cc
file  simple_purification.h [code]