Skip to content

Refactor:Change potentials to module_pot #6070

New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Merged
mohanchen merged 3 commits into from
Mar 28, 2025
Merged

Refactor:Change potentials to module_pot #6070

Show file tree
Hide file tree
Changes from all commits
Commits
Show all changes
3 commits
Select commit Hold shift + click to select a range
16c1a7a
modify name
A-006 Mar 28, 2025
4a20f7b
modify file include
A-006 Mar 28, 2025
bc7c14c
add the CMakefile
A-006 Mar 28, 2025
File filter

Filter by extension

Filter by extension
Conversations
Failed to load comments.
Loading
Jump to
Jump to file
Failed to load files.
Loading
Diff view
Diff view
2 changes: 1 addition & 1 deletion source/Makefile.Objects
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -35,7 +35,7 @@ VPATH=./src_global:\
./module_hsolver/module_pexsi:\
./module_elecstate:\
./module_elecstate/kernels:\
./module_elecstate/potentials:\
./module_elecstate/module_pot:\
./module_elecstate/module_charge:\
./module_elecstate/module_dm:\
./module_psi:\
Expand Down
18 changes: 9 additions & 9 deletions source/module_elecstate/CMakeLists.txt
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -8,14 +8,14 @@ list(APPEND objects
elecstate_pw.cpp
elecstate_pw_sdft.cpp
elecstate_pw_cal_tau.cpp
potentials/gatefield.cpp
potentials/efield.cpp
potentials/H_Hartree_pw.cpp
potentials/pot_xc.cpp
potentials/pot_local.cpp
potentials/pot_local_paw.cpp
potentials/potential_new.cpp
potentials/potential_types.cpp
module_pot/gatefield.cpp
module_pot/efield.cpp
module_pot/H_Hartree_pw.cpp
module_pot/pot_xc.cpp
module_pot/pot_local.cpp
module_pot/pot_local_paw.cpp
module_pot/potential_new.cpp
module_pot/potential_types.cpp
module_charge/charge.cpp
module_charge/charge_init.cpp
module_charge/charge_mpi.cpp
Expand All @@ -42,7 +42,7 @@ if(ENABLE_LCAO)
list(APPEND objects
elecstate_lcao.cpp
elecstate_lcao_cal_tau.cpp
potentials/H_TDDFT_pw.cpp
module_pot/H_TDDFT_pw.cpp
module_dm/density_matrix.cpp
module_dm/density_matrix_io.cpp
module_dm/cal_dm_psi.cpp
Expand Down
2 changes: 1 addition & 1 deletion source/module_elecstate/elecstate.h
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -5,7 +5,7 @@
#include "module_elecstate/module_charge/charge.h"
#include "module_parameter/parameter.h"
#include "module_psi/psi.h"
#include "potentials/potential_new.h"
#include "module_pot/potential_new.h"

namespace elecstate
{
Expand Down
6 changes: 3 additions & 3 deletions source/module_elecstate/elecstate_energy_terms.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
#include "elecstate.h"
#include "module_elecstate/potentials/H_Hartree_pw.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/H_Hartree_pw.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_lcao/module_deepks/LCAO_deepks.h"
#include "module_hamilt_lcao/module_deltaspin/spin_constrain.h"
#include "module_hamilt_lcao/module_dftu/dftu.h"
Expand Down
6 changes: 3 additions & 3 deletions source/module_elecstate/elecstate_print.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -2,9 +2,9 @@
#include "module_base/formatter.h"
#include "module_base/global_variable.h"
#include "module_base/parallel_common.h"
#include "module_elecstate/potentials/H_Hartree_pw.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/H_Hartree_pw.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_general/module_xc/xc_functional.h"
#include "module_hamilt_lcao/module_deepks/LCAO_deepks.h"
#include "module_parameter/parameter.h"
Expand Down
0 ...ule_elecstate/potentials/H_Hartree_pw.cpp → ...ule_elecstate/module_pot/H_Hartree_pw.cpp
View file
Open in desktop
File renamed without changes.
0 ...odule_elecstate/potentials/H_Hartree_pw.h → ...odule_elecstate/module_pot/H_Hartree_pw.h
View file
Open in desktop
File renamed without changes.
0 ...odule_elecstate/potentials/H_TDDFT_pw.cpp → ...odule_elecstate/module_pot/H_TDDFT_pw.cpp
View file
Open in desktop
File renamed without changes.
0 .../module_elecstate/potentials/H_TDDFT_pw.h → .../module_elecstate/module_pot/H_TDDFT_pw.h
View file
Open in desktop
File renamed without changes.
0 ...ce/module_elecstate/potentials/efield.cpp → ...ce/module_elecstate/module_pot/efield.cpp
View file
Open in desktop
File renamed without changes.
0 source/module_elecstate/potentials/efield.h → source/module_elecstate/module_pot/efield.h
View file
Open in desktop
File renamed without changes.
0 ...module_elecstate/potentials/gatefield.cpp → ...module_elecstate/module_pot/gatefield.cpp
View file
Open in desktop
File renamed without changes.
0 ...e/module_elecstate/potentials/gatefield.h → ...e/module_elecstate/module_pot/gatefield.h
View file
Open in desktop
File renamed without changes.
0 ...ce/module_elecstate/potentials/pot_base.h → ...ce/module_elecstate/module_pot/pot_base.h
View file
Open in desktop
File renamed without changes.
0 ...module_elecstate/potentials/pot_local.cpp → ...module_elecstate/module_pot/pot_local.cpp
View file
Open in desktop
File renamed without changes.
0 ...e/module_elecstate/potentials/pot_local.h → ...e/module_elecstate/module_pot/pot_local.h
View file
Open in desktop
File renamed without changes.
0 ...le_elecstate/potentials/pot_local_paw.cpp → ...le_elecstate/module_pot/pot_local_paw.cpp
View file
Open in desktop
File renamed without changes.
0 ...dule_elecstate/potentials/pot_local_paw.h → ...dule_elecstate/module_pot/pot_local_paw.h
View file
Open in desktop
File renamed without changes.
0 ...dule_elecstate/potentials/pot_surchem.hpp → ...dule_elecstate/module_pot/pot_surchem.hpp
View file
Open in desktop
File renamed without changes.
0 ...ce/module_elecstate/potentials/pot_xc.cpp → ...ce/module_elecstate/module_pot/pot_xc.cpp
View file
Open in desktop
File renamed without changes.
0 source/module_elecstate/potentials/pot_xc.h → source/module_elecstate/module_pot/pot_xc.h
View file
Open in desktop
File renamed without changes.
0 ...le_elecstate/potentials/potential_new.cpp → ...le_elecstate/module_pot/potential_new.cpp
View file
Open in desktop
File renamed without changes.
0 ...dule_elecstate/potentials/potential_new.h → ...dule_elecstate/module_pot/potential_new.h
View file
Open in desktop
File renamed without changes.
0 ..._elecstate/potentials/potential_types.cpp → ..._elecstate/module_pot/potential_types.cpp
View file
Open in desktop
File renamed without changes.
2 changes: 1 addition & 1 deletion source/module_elecstate/test/CMakeLists.txt
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -75,7 +75,7 @@ AddTest(
AddTest(
TARGET potentials_new
LIBS parameter ${math_libs} base device planewave_serial
SOURCES potential_new_test.cpp ../potentials/potential_new.cpp
SOURCES potential_new_test.cpp ../module_pot/potential_new.cpp
)

AddTest(
Expand Down
4 changes: 2 additions & 2 deletions source/module_elecstate/test/elecstate_print_test.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -6,8 +6,8 @@
#include "module_cell/klist.h"
#include "module_elecstate/elecstate.h"
#include "module_elecstate/module_charge/charge.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_general/module_xc/xc_functional.h"
#include "module_parameter/parameter.h"
#include "module_elecstate/elecstate_print.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_elecstate/test/potential_new_test.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -2,7 +2,7 @@
#include <vector>

#define private public
#include "module_elecstate/potentials/potential_new.h"
#include "module_elecstate/module_pot/potential_new.h"
#include "module_hamilt_general/module_xc/xc_functional.h"
#include "module_parameter/parameter.h"
// mock functions
Expand Down
2 changes: 1 addition & 1 deletion source/module_elecstate/test/potentials_base_test.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,5 +1,5 @@
#include "gtest/gtest.h"
#include "module_elecstate/potentials/pot_base.h"
#include "module_elecstate/module_pot/pot_base.h"

ModuleBase::matrix::~matrix(){}

Expand Down
4 changes: 2 additions & 2 deletions source/module_esolver/esolver_of_tool.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,8 +1,8 @@
#include "esolver_of.h"
#include "module_base/formatter.h"
#include "module_base/memory.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_pw/hamilt_pwdft/global.h"
#include "module_parameter/parameter.h"
#include "module_elecstate/cal_ux.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_lcao/hamilt_lcaodft/FORCE.h
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -7,7 +7,7 @@
#include "module_basis/module_nao/two_center_bundle.h"
#include "module_elecstate/elecstate.h"
#include "module_elecstate/module_dm/density_matrix.h"
#include "module_elecstate/potentials/potential_new.h"
#include "module_elecstate/module_pot/potential_new.h"
#include "module_hamilt_lcao/hamilt_lcaodft/force_stress_arrays.h"
#include "module_hamilt_lcao/module_deepks/LCAO_deepks.h"
#include "module_hamilt_lcao/module_gint/gint_gamma.h"
Expand Down
6 changes: 3 additions & 3 deletions source/module_hamilt_lcao/hamilt_lcaodft/FORCE_STRESS.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -8,9 +8,9 @@
#include "module_base/timer.h"
#include "module_cell/module_neighbor/sltk_grid_driver.h"
#include "module_elecstate/elecstate_lcao.h"
#include "module_elecstate/potentials/H_TDDFT_pw.h" // Taoni add 2025-02-20
#include "module_elecstate/potentials/efield.h" // liuyu add 2022-05-18
#include "module_elecstate/potentials/gatefield.h" // liuyu add 2022-09-13
#include "module_elecstate/module_pot/H_TDDFT_pw.h" // Taoni add 2025-02-20
#include "module_elecstate/module_pot/efield.h" // liuyu add 2022-05-18
#include "module_elecstate/module_pot/gatefield.h" // liuyu add 2022-09-13
#include "module_hamilt_general/module_surchem/surchem.h" //sunml add 2022-08-10
#include "module_hamilt_general/module_vdw/vdw.h"
#include "module_parameter/parameter.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_lcao/hamilt_lcaodft/hamilt_lcao.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -23,7 +23,7 @@
#include "module_hsolver/diago_elpa.h"
#endif

#include "module_elecstate/potentials/H_TDDFT_pw.h"
#include "module_elecstate/module_pot/H_TDDFT_pw.h"
#include "module_hamilt_general/module_xc/xc_functional.h"
#include "module_hamilt_lcao/module_deltaspin/spin_constrain.h"
#include "module_hamilt_lcao/module_hcontainer/hcontainer_funcs.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_lcao/hamilt_lcaodft/hamilt_lcao.h
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -5,7 +5,7 @@
#include "module_cell/klist.h"
#include "module_cell/module_neighbor/sltk_atom_arrange.h"
#include "module_elecstate/module_dm/density_matrix.h"
#include "module_elecstate/potentials/potential_new.h"
#include "module_elecstate/module_pot/potential_new.h"
#include "module_hamilt_general/hamilt.h"
#include "module_hamilt_lcao/hamilt_lcaodft/hs_matrix_k.hpp"
#include "module_hamilt_lcao/module_gint/gint_gamma.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/td_ekinetic_lcao.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -6,7 +6,7 @@
#include "module_base/timer.h"
#include "module_base/tool_title.h"
#include "module_cell/module_neighbor/sltk_grid_driver.h"
#include "module_elecstate/potentials/H_TDDFT_pw.h"
#include "module_elecstate/module_pot/H_TDDFT_pw.h"
#include "module_hamilt_lcao/hamilt_lcaodft/center2_orb-orb11.h"
#include "module_hamilt_lcao/hamilt_lcaodft/spar_hsr.h"
#include "module_hamilt_lcao/module_hcontainer/hcontainer_funcs.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/td_nonlocal_lcao.h
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -3,7 +3,7 @@
#include "module_basis/module_ao/parallel_orbitals.h"
#include "module_cell/module_neighbor/sltk_grid_driver.h"
#include "module_cell/unitcell.h"
#include "module_elecstate/potentials/H_TDDFT_pw.h"
#include "module_elecstate/module_pot/H_TDDFT_pw.h"
#include "module_hamilt_lcao/hamilt_lcaodft/operator_lcao/operator_lcao.h"
#include "module_hamilt_lcao/module_hcontainer/hcontainer.h"
#include "module_hamilt_lcao/module_tddft/td_velocity.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/veff_lcao.h
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
#ifndef VEFFLCAO_H
#define VEFFLCAO_H
#include "module_base/timer.h"
#include "module_elecstate/potentials/potential_new.h"
#include "module_elecstate/module_pot/potential_new.h"
#include "module_hamilt_lcao/module_gint/gint_gamma.h"
#include "module_hamilt_lcao/module_gint/gint_k.h"
#include "operator_lcao.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_lcao/hamilt_lcaodft/pulay_force_stress.h
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -3,7 +3,7 @@
#include "module_elecstate/module_dm/density_matrix.h"
#include "module_hamilt_lcao/module_gint/gint_gamma.h"
#include "module_hamilt_lcao/module_gint/gint_k.h"
#include "module_elecstate/potentials/potential_new.h"
#include "module_elecstate/module_pot/potential_new.h"
#include "module_cell/unitcell.h"
#include "module_hamilt_lcao/hamilt_lcaodft/stress_tools.h"
#ifndef TGINT_H
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_lcao/module_tddft/td_velocity.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,6 +1,6 @@
#include "td_velocity.h"

#include "module_elecstate/potentials/H_TDDFT_pw.h"
#include "module_elecstate/module_pot/H_TDDFT_pw.h"
#include "module_parameter/parameter.h"

bool TD_Velocity::tddft_velocity = false;
Expand Down
4 changes: 2 additions & 2 deletions source/module_hamilt_pw/hamilt_pwdft/forces.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -10,8 +10,8 @@
#include "module_base/mathzone.h"
#include "module_base/timer.h"
#include "module_base/tool_threading.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_general/module_ewald/H_Ewald_pw.h"
#include "module_hamilt_general/module_surchem/surchem.h"
#include "module_hamilt_general/module_vdw/vdw.h"
Expand Down
4 changes: 2 additions & 2 deletions source/module_hamilt_pw/hamilt_pwdft/forces_cc.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -10,8 +10,8 @@
#include "module_base/timer.h"
#include "module_base/tool_threading.h"
#include "module_elecstate/cal_ux.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_general/module_ewald/H_Ewald_pw.h"
#include "module_hamilt_general/module_surchem/surchem.h"
#include "module_hamilt_general/module_vdw/vdw.h"
Expand Down
4 changes: 2 additions & 2 deletions source/module_hamilt_pw/hamilt_pwdft/forces_scc.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -8,8 +8,8 @@
#include "module_base/mathzone.h"
#include "module_base/timer.h"
#include "module_base/tool_threading.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_general/module_ewald/H_Ewald_pw.h"
#include "module_hamilt_general/module_surchem/surchem.h"
#include "module_hamilt_general/module_vdw/vdw.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_pw/hamilt_pwdft/hamilt_pw.h
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -3,7 +3,7 @@

#include "module_base/macros.h"
#include "module_cell/klist.h"
#include "module_elecstate/potentials/potential_new.h"
#include "module_elecstate/module_pot/potential_new.h"
#include "module_esolver/esolver_ks_pw.h"
#include "module_hamilt_general/hamilt.h"
#include "module_hamilt_pw/hamilt_pwdft/VNL_in_pw.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_hamilt_pw/hamilt_pwdft/stress_func_har.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,5 +1,5 @@
#include "stress_func.h"
#include "module_elecstate/potentials/H_Hartree_pw.h"
#include "module_elecstate/module_pot/H_Hartree_pw.h"
#include "module_parameter/parameter.h"
#include "module_base/timer.h"
#include "module_hamilt_pw/hamilt_pwdft/global.h"
Expand Down
4 changes: 2 additions & 2 deletions source/module_hamilt_pw/hamilt_stodft/sto_forces.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -3,8 +3,8 @@
#include "module_base/mathzone.h"
#include "module_cell/module_symmetry/symmetry.h"
#include "module_elecstate/elecstate.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_pw/hamilt_pwdft/global.h"
#include "module_io/output_log.h"
#include "module_parameter/parameter.h"
Expand Down
6 changes: 3 additions & 3 deletions source/module_io/input_conv.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -21,7 +21,7 @@
#include "module_hamilt_lcao/module_dftu/dftu.h"
#ifdef __LCAO
#include "module_basis/module_ao/ORB_read.h"
#include "module_elecstate/potentials/H_TDDFT_pw.h"
#include "module_elecstate/module_pot/H_TDDFT_pw.h"
#include "module_hamilt_lcao/hamilt_lcaodft/FORCE_STRESS.h"
#include "module_hamilt_lcao/module_tddft/evolve_elec.h"
#include "module_hamilt_lcao/module_tddft/td_velocity.h"
Expand All @@ -37,8 +37,8 @@
#include "module_base/module_device/device.h"
#include "module_base/timer.h"
#include "module_elecstate/elecstate_lcao.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hsolver/hsolver_lcao.h"
#include "module_hsolver/hsolver_pw.h"
#include "module_md/md_func.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_io/td_current_io.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -8,7 +8,7 @@
#include "module_base/tool_threading.h"
#include "module_base/vector3.h"
#include "module_elecstate/module_dm/cal_dm_psi.h"
#include "module_elecstate/potentials/H_TDDFT_pw.h"
#include "module_elecstate/module_pot/H_TDDFT_pw.h"
#include "module_hamilt_lcao/hamilt_lcaodft/LCAO_domain.h"
#include "module_hamilt_lcao/module_tddft/td_current.h"
#include "module_hamilt_lcao/module_tddft/td_velocity.h"
Expand Down
6 changes: 3 additions & 3 deletions source/module_io/test/for_testing_input_conv.h
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -7,9 +7,9 @@
#include "module_elecstate/elecstate_lcao.h"
#include "module_elecstate/module_charge/charge_mixing.h"
#include "module_elecstate/occupy.h"
#include "module_elecstate/potentials/H_TDDFT_pw.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/potentials/gatefield.h"
#include "module_elecstate/module_pot/H_TDDFT_pw.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_elecstate/module_pot/gatefield.h"
#include "module_hamilt_lcao/hamilt_lcaodft/FORCE_STRESS.h"
#include "module_hamilt_lcao/module_dftu/dftu.h"
#include "module_hamilt_lcao/module_tddft/evolve_elec.h"
Expand Down
4 changes: 2 additions & 2 deletions source/module_io/write_elecstat_pot.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,8 +1,8 @@
#include "module_base/element_name.h"
#include "module_base/timer.h"
#include "module_parameter/parameter.h"
#include "module_elecstate/potentials/H_Hartree_pw.h"
#include "module_elecstate/potentials/efield.h"
#include "module_elecstate/module_pot/H_Hartree_pw.h"
#include "module_elecstate/module_pot/efield.h"
#include "module_hamilt_pw/hamilt_pwdft/global.h"
#include "module_io/cube_io.h"
#include "module_io/output_log.h"
Expand Down
2 changes: 1 addition & 1 deletion source/module_io/write_vxc_lip.hpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -7,7 +7,7 @@
#include "module_psi/psi.h"
#include "module_cell/unitcell.h"
#include "module_cell/klist.h"
#include "module_elecstate/potentials/potential_new.h"
#include "module_elecstate/module_pot/potential_new.h"
#include "module_io/write_HS.h"
#include <type_traits>

Expand Down
2 changes: 1 addition & 1 deletion source/module_lr/potentials/pot_hxc_lrtd.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,6 +1,6 @@
#include "pot_hxc_lrtd.h"
#include "module_parameter/parameter.h"
#include "module_elecstate/potentials/H_Hartree_pw.h"
#include "module_elecstate/module_pot/H_Hartree_pw.h"
#include "module_base/timer.h"
#include "module_hamilt_general/module_xc/xc_functional.h"
#include <set>
Expand Down
2 changes: 1 addition & 1 deletion source/module_lr/potentials/pot_hxc_lrtd.h
View file
Open in desktop
Original file line number Diff line number Diff line change
@@ -1,5 +1,5 @@
#pragma once
#include "module_elecstate/potentials/H_Hartree_pw.h"
#include "module_elecstate/module_pot/H_Hartree_pw.h"
#include "xc_kernel.h"
#include <unordered_map>
#include <memory>
Expand Down
6 changes: 3 additions & 3 deletions source/module_rdmft/rdmft_tools.cpp
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -8,9 +8,9 @@
#include "module_base/tool_title.h"
#include "module_base/timer.h"
#include "module_hamilt_general/module_xc/xc_functional.h"
#include "module_elecstate/potentials/H_Hartree_pw.h"
#include "module_elecstate/potentials/pot_local.h"
#include "module_elecstate/potentials/pot_xc.h"
#include "module_elecstate/module_pot/H_Hartree_pw.h"
#include "module_elecstate/module_pot/pot_local.h"
#include "module_elecstate/module_pot/pot_xc.h"
#include "module_hamilt_pw/hamilt_pwdft/structure_factor.h"

#include <iostream>
Expand Down
2 changes: 1 addition & 1 deletion source/module_rdmft/rdmft_tools.h
View file
Open in desktop
Original file line number Diff line number Diff line change
Expand Up @@ -11,7 +11,7 @@
#include "module_cell/unitcell.h"
#include "module_hamilt_lcao/module_gint/gint_gamma.h"
#include "module_hamilt_lcao/module_gint/gint_k.h"
#include "module_elecstate/potentials/potential_new.h"
#include "module_elecstate/module_pot/potential_new.h"
#include "module_base/blas_connector.h"
#include "module_base/scalapack_connector.h"
#include "module_base/parallel_2d.h"
Expand Down