app_exx.h Source File

LibRPA: app_exx.h Source File
LibRPA
app_exx.h
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1 
6 #pragma once
7 #include <vector>
8 
9 namespace LIBRPA
10 {
11 
12 namespace app
13 {
14 
33 std::vector<double>
34 compute_exx_orbital_energy_(int i_state_low, int i_state_high,
35  int n_kpoints_task, const int *i_kpoints_task);
36 
37 } /* end of namespace app */
38 
39 } /* end of namespace LIBRPA */
std::vector< double > compute_exx_orbital_energy_(int i_state_low, int i_state_high, int n_kpoints_task, const int *i_kpoints_task)
Compute the exact exchange (EXX) energy for states at specified k-points.
Definition: app_exx.cpp:20
Definition: analycont.cpp:14