Rename module_elecstate to source_estate

Author: Critsium-xy

docs/CONTRIBUTING.md

@@ -54,7 +54,7 @@ For those who are interested in the source code, the following figure shows the
 |   |-- module_neighbor         The module for finding the neighbors of each atom in the unit cell.
 |   |-- module_paw              The module for performing PAW calculations.
 |   |-- module_symmetry         The module for finding the symmetry operations of the unit cell.
-|-- module_elecstate            The module for defining the electronic state and its operations.
+|-- source_estate            The module for defining the electronic state and its operations.
 |   |-- module_charge           The module for calculating the charge density, charge mixing
 |   |-- potentials              The module for calculating the potentials, including Hartree, exchange-correlation, local pseudopotential, etc.
 |-- source_esolver              The module defining task-specific driver of corresponding workflow for evaluating energies, forces, etc., including lj, dp, ks, sdft, ofdft, etc.

source/CMakeLists.txt

@@ -1,7 +1,7 @@
 add_subdirectory(source_base)
 add_subdirectory(source_cell)
 add_subdirectory(module_psi)
-add_subdirectory(module_elecstate)
+add_subdirectory(source_estate)
 add_subdirectory(module_hamilt_general)
 add_subdirectory(module_hamilt_pw)
 add_subdirectory(module_hamilt_lcao)
@@ -37,7 +37,7 @@ list(APPEND device_srcs
   source_basis/module_pw/kernels/pw_op.cpp
   source_hsolver/kernels/dngvd_op.cpp
   source_hsolver/kernels/bpcg_kernel_op.cpp
-  module_elecstate/kernels/elecstate_op.cpp
+  source_estate/kernels/elecstate_op.cpp
 
   # module_psi/kernels/psi_memory_op.cpp
   # module_psi/kernels/device.cpp
@@ -67,7 +67,7 @@ if(USE_CUDA)
     source_basis/module_pw/kernels/cuda/pw_op.cu
     source_hsolver/kernels/cuda/dngvd_op.cu
     source_hsolver/kernels/cuda/bpcg_kernel_op.cu
-    module_elecstate/kernels/cuda/elecstate_op.cu
+    source_estate/kernels/cuda/elecstate_op.cu
 
     # module_psi/kernels/cuda/memory_op.cu
     source_base/module_device/cuda/memory_op.cu
@@ -94,7 +94,7 @@ if(USE_ROCM)
     source_basis/module_pw/kernels/rocm/pw_op.hip.cu
     source_hsolver/kernels/rocm/dngvd_op.hip.cu
     source_hsolver/kernels/rocm/bpcg_kernel_op.hip.cu
-    module_elecstate/kernels/rocm/elecstate_op.hip.cu
+    source_estate/kernels/rocm/elecstate_op.hip.cu
 
     # module_psi/kernels/rocm/memory_op.hip.cu
     source_base/module_device/rocm/memory_op.hip.cu

source/Makefile.Objects

@@ -34,11 +34,11 @@ VPATH=./src_global:\
 ./source_hsolver/kernels:\
 ./source_hsolver/genelpa:\
 ./source_hsolver/module_pexsi:\
-./module_elecstate:\
-./module_elecstate/kernels:\
-./module_elecstate/module_pot:\
-./module_elecstate/module_charge:\
-./module_elecstate/module_dm:\
+./source_estate:\
+./source_estate/kernels:\
+./source_estate/module_pot:\
+./source_estate/module_charge:\
+./source_estate/module_dm:\
 ./module_psi:\
 ./module_psi/kernels:\
 ./module_hamilt_general:\

source/module_hamilt_general/module_xc/xc_functional.h

@@ -17,7 +17,7 @@
 #include "source_base/matrix.h"
 #include "exx_info.h"
 #include "source_basis/module_pw/pw_basis_k.h"
-#include "module_elecstate/module_charge/charge.h"
+#include "source_estate/module_charge/charge.h"
 #include "source_cell/unitcell.h"
 
 #include <map> // added by jghan, 2024-10-10

source/module_hamilt_general/module_xc/xc_functional_libxc_tools.cpp

@@ -2,7 +2,7 @@
 
 #include "xc_functional_libxc.h"
 #include "xc_functional.h"
-#include "module_elecstate/module_charge/charge.h"
+#include "source_estate/module_charge/charge.h"
 #include "module_parameter/parameter.h"
 
 // converting rho (abacus=>libxc)

source/module_hamilt_general/module_xc/xc_functional_libxc_vxc.cpp

@@ -2,7 +2,7 @@
 
 #include "xc_functional.h"
 #include "xc_functional_libxc.h"
-#include "module_elecstate/module_charge/charge.h"
+#include "source_estate/module_charge/charge.h"
 #include "source_base/global_variable.h"
 #include "module_parameter/parameter.h"
 #include "source_base/parallel_reduce.h"

source/module_hamilt_lcao/hamilt_lcaodft/FORCE.h

@@ -5,9 +5,9 @@
 #include "source_base/global_variable.h"
 #include "source_base/matrix.h"
 #include "source_basis/module_nao/two_center_bundle.h"
-#include "module_elecstate/elecstate.h"
-#include "module_elecstate/module_dm/density_matrix.h"
-#include "module_elecstate/module_pot/potential_new.h"
+#include "source_estate/elecstate.h"
+#include "source_estate/module_dm/density_matrix.h"
+#include "source_estate/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"

source/module_hamilt_lcao/hamilt_lcaodft/FORCE_STRESS.cpp

@@ -7,10 +7,10 @@
 // new
 #include "source_base/timer.h"
 #include "source_cell/module_neighbor/sltk_grid_driver.h"
-#include "module_elecstate/elecstate_lcao.h"
-#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 "source_estate/elecstate_lcao.h"
+#include "source_estate/module_pot/H_TDDFT_pw.h"       // Taoni add 2025-02-20
+#include "source_estate/module_pot/efield.h"           // liuyu add 2022-05-18
+#include "source_estate/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"

source/module_hamilt_lcao/hamilt_lcaodft/FORCE_gamma.cpp

@@ -10,7 +10,7 @@
 #include "module_hamilt_lcao/module_deepks/LCAO_deepks_io.h"
 #endif
 #include "source_cell/module_neighbor/sltk_grid_driver.h" //GridD
-#include "module_elecstate/elecstate_lcao.h"
+#include "source_estate/elecstate_lcao.h"
 #include "module_hamilt_lcao/hamilt_lcaodft/LCAO_domain.h"
 #include "module_hamilt_lcao/hamilt_lcaodft/pulay_force_stress.h"
 #include "module_io/write_HS.h"

source/module_hamilt_lcao/hamilt_lcaodft/FORCE_k.cpp

@@ -5,9 +5,9 @@
 #include "source_base/tool_threading.h"
 #include "source_basis/module_ao/ORB_read.h"
 #include "source_cell/module_neighbor/sltk_grid_driver.h"
-#include "module_elecstate/cal_dm.h"
-#include "module_elecstate/elecstate_lcao.h"
-#include "module_elecstate/module_dm/cal_dm_psi.h"
+#include "source_estate/cal_dm.h"
+#include "source_estate/elecstate_lcao.h"
+#include "source_estate/module_dm/cal_dm_psi.h"
 #include "module_hamilt_lcao/hamilt_lcaodft/LCAO_domain.h"
 #include "module_hamilt_lcao/hamilt_lcaodft/pulay_force_stress.h"
 #include "module_hamilt_pw/hamilt_pwdft/global.h"