SIRIUS 7.5.0
Electronic structure library and applications
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Helper function for nlcglib. More...
Go to the source code of this file.
Namespaces | |
module | sirius |
Namespace of the SIRIUS library. | |
Functions | |
void | sirius::apply_hamiltonian (Hamiltonian0< double > &H0, K_point< double > &kp, wf::Wave_functions< double > &wf_out, wf::Wave_functions< double > &wf, std::shared_ptr< wf::Wave_functions< double > > swf) |
Helper function for nlcglib.
Definition in file apply_hamiltonian.hpp.