fix UTs

Qianruipku · Qianruipku · commit 337490947121 · 2024-12-18T09:50:58.000+08:00
diff --git a/source/module_elecstate/module_dm/test/test_cal_dm_R.cpp b/source/module_elecstate/module_dm/test/test_cal_dm_R.cpp
@@ -78,8 +78,6 @@ class DMTest : public testing::Test
     {
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI
diff --git a/source/module_elecstate/module_dm/test/test_cal_dmk_psi.cpp b/source/module_elecstate/module_dm/test/test_cal_dmk_psi.cpp
@@ -74,8 +74,6 @@ class DMTest : public testing::Test
         delete[] ucell.atoms[0].iw2m;
         delete[] ucell.atoms[0].iw2n;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI
diff --git a/source/module_elecstate/module_dm/test/test_dm_R_init.cpp b/source/module_elecstate/module_dm/test/test_dm_R_init.cpp
@@ -78,8 +78,6 @@ class DMTest : public testing::Test
     {
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI
diff --git a/source/module_elecstate/module_dm/test/test_dm_constructor.cpp b/source/module_elecstate/module_dm/test/test_dm_constructor.cpp
@@ -75,8 +75,6 @@ class DMTest : public testing::Test
     {
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI
diff --git a/source/module_esolver/test/esolver_dp_test.cpp b/source/module_esolver/test/esolver_dp_test.cpp
@@ -65,8 +65,6 @@ class ESolverDPTest : public ::testing::Test
     {
         // Clean up after each test
         delete esolver;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
         delete[] ucell.atoms;
         delete[] ucell.atom_label;
     }
diff --git a/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_T_NL_cd.cpp b/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_T_NL_cd.cpp
@@ -92,8 +92,6 @@ class TNLTest : public ::testing::Test
         delete HR;
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
         delete[] ucell.infoNL.Beta;
     }
 
diff --git a/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_dftu.cpp b/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_dftu.cpp
@@ -106,8 +106,6 @@ class DFTUTest : public ::testing::Test
         delete DMR;
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI
diff --git a/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_ekineticnew.cpp b/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_ekineticnew.cpp
@@ -66,8 +66,6 @@ class EkineticNewTest : public ::testing::Test
         delete HR;
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI
diff --git a/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_nonlocalnew.cpp b/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_nonlocalnew.cpp
@@ -90,8 +90,6 @@ class NonlocalNewTest : public ::testing::Test
         delete HR;
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
         delete[] ucell.infoNL.Beta;
     }
 
diff --git a/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_overlapnew.cpp b/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_overlapnew.cpp
@@ -66,8 +66,6 @@ class OverlapNewTest : public ::testing::Test
         delete SR;
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI
diff --git a/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_overlapnew_cd.cpp b/source/module_hamilt_lcao/hamilt_lcaodft/operator_lcao/test/test_overlapnew_cd.cpp
@@ -65,8 +65,6 @@ class OverlapNewTest : public ::testing::Test
         delete SR;
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI
diff --git a/source/module_hamilt_lcao/module_hcontainer/test/test_func_folding.cpp b/source/module_hamilt_lcao/module_hcontainer/test/test_func_folding.cpp
@@ -36,7 +36,6 @@ class FoldingTest : public ::testing::Test
     void TearDown() override
     {
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
     }
 
     UnitCell ucell;
diff --git a/source/module_hamilt_lcao/module_hcontainer/test/test_hcontainer.cpp b/source/module_hamilt_lcao/module_hcontainer/test/test_hcontainer.cpp
@@ -40,7 +40,6 @@ class HContainerTest : public ::testing::Test
     {
         delete HR;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
     }
 
     UnitCell ucell;
diff --git a/source/module_hamilt_lcao/module_hcontainer/test/test_hcontainer_complex.cpp b/source/module_hamilt_lcao/module_hcontainer/test/test_hcontainer_complex.cpp
@@ -40,7 +40,6 @@ class HContainerTest : public ::testing::Test
     {
         delete HR;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
     }
 
     UnitCell ucell;
diff --git a/source/module_hamilt_lcao/module_hcontainer/test/test_hcontainer_output.cpp b/source/module_hamilt_lcao/module_hcontainer/test/test_hcontainer_output.cpp
@@ -56,10 +56,6 @@ class OutputHContainerTest : public testing::Test
     void TearDown() override
     {
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
-        delete[] ucell.iwt2iat;
-        delete[] ucell.iwt2iw;
     }
 };
 
diff --git a/source/module_hamilt_lcao/module_hcontainer/test/test_hcontainer_time.cpp b/source/module_hamilt_lcao/module_hcontainer/test/test_hcontainer_time.cpp
@@ -39,7 +39,6 @@ class HContainerTest : public ::testing::Test
     {
         delete HR;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
     }
 
     UnitCell ucell;
diff --git a/source/module_hamilt_lcao/module_hcontainer/test/test_transfer.cpp b/source/module_hamilt_lcao/module_hcontainer/test/test_transfer.cpp
@@ -49,8 +49,6 @@ class TransferTest : public ::testing::Test
         delete HR_para;
         delete paraV;
         delete[] ucell.atoms;
-        delete[] ucell.iat2it;
-        delete[] ucell.iat2ia;
     }
 
 #ifdef __MPI

Original file line number	Diff line number	Diff line change
`@@ -78,8 +78,6 @@ class DMTest : public testing::Test`
`78`	`78`	`{`
`79`	`79`	`delete paraV;`
`80`	`80`	`delete[] ucell.atoms;`
`81`		`- delete[] ucell.iat2it;`
`82`		`- delete[] ucell.iat2ia;`
`83`	`81`	`}`
`84`	`82`
`85`	`83`	`#ifdef __MPI`
Original file line number	Diff line number	Diff line change
`@@ -74,8 +74,6 @@ class DMTest : public testing::Test`
`74`	`74`	`delete[] ucell.atoms[0].iw2m;`
`75`	`75`	`delete[] ucell.atoms[0].iw2n;`
`76`	`76`	`delete[] ucell.atoms;`
`77`		`- delete[] ucell.iat2it;`
`78`		`- delete[] ucell.iat2ia;`
`79`	`77`	`}`
`80`	`78`
`81`	`79`	`#ifdef __MPI`
Original file line number	Diff line number	Diff line change
`@@ -75,8 +75,6 @@ class DMTest : public testing::Test`
`75`	`75`	`{`
`76`	`76`	`delete paraV;`
`77`	`77`	`delete[] ucell.atoms;`
`78`		`- delete[] ucell.iat2it;`
`79`		`- delete[] ucell.iat2ia;`
`80`	`78`	`}`
`81`	`79`
`82`	`80`	`#ifdef __MPI`
Original file line number	Diff line number	Diff line change
`@@ -65,8 +65,6 @@ class ESolverDPTest : public ::testing::Test`
`65`	`65`	`{`
`66`	`66`	`// Clean up after each test`
`67`	`67`	`delete esolver;`
`68`		`- delete[] ucell.iat2it;`
`69`		`- delete[] ucell.iat2ia;`
`70`	`68`	`delete[] ucell.atoms;`
`71`	`69`	`delete[] ucell.atom_label;`
`72`	`70`	`}`
Original file line number	Diff line number	Diff line change
`@@ -92,8 +92,6 @@ class TNLTest : public ::testing::Test`
`92`	`92`	`delete HR;`
`93`	`93`	`delete paraV;`
`94`	`94`	`delete[] ucell.atoms;`
`95`		`- delete[] ucell.iat2it;`
`96`		`- delete[] ucell.iat2ia;`
`97`	`95`	`delete[] ucell.infoNL.Beta;`
`98`	`96`	`}`
`99`	`97`
Original file line number	Diff line number	Diff line change
`@@ -106,8 +106,6 @@ class DFTUTest : public ::testing::Test`
`106`	`106`	`delete DMR;`
`107`	`107`	`delete paraV;`
`108`	`108`	`delete[] ucell.atoms;`
`109`		`- delete[] ucell.iat2it;`
`110`		`- delete[] ucell.iat2ia;`
`111`	`109`	`}`
`112`	`110`
`113`	`111`	`#ifdef __MPI`
Original file line number	Diff line number	Diff line change
`@@ -66,8 +66,6 @@ class EkineticNewTest : public ::testing::Test`
`66`	`66`	`delete HR;`
`67`	`67`	`delete paraV;`
`68`	`68`	`delete[] ucell.atoms;`
`69`		`- delete[] ucell.iat2it;`
`70`		`- delete[] ucell.iat2ia;`
`71`	`69`	`}`
`72`	`70`
`73`	`71`	`#ifdef __MPI`
Original file line number	Diff line number	Diff line change
`@@ -90,8 +90,6 @@ class NonlocalNewTest : public ::testing::Test`
`90`	`90`	`delete HR;`
`91`	`91`	`delete paraV;`
`92`	`92`	`delete[] ucell.atoms;`
`93`		`- delete[] ucell.iat2it;`
`94`		`- delete[] ucell.iat2ia;`
`95`	`93`	`delete[] ucell.infoNL.Beta;`
`96`	`94`	`}`
`97`	`95`
Original file line number	Diff line number	Diff line change
`@@ -66,8 +66,6 @@ class OverlapNewTest : public ::testing::Test`
`66`	`66`	`delete SR;`
`67`	`67`	`delete paraV;`
`68`	`68`	`delete[] ucell.atoms;`
`69`		`- delete[] ucell.iat2it;`
`70`		`- delete[] ucell.iat2ia;`
`71`	`69`	`}`
`72`	`70`
`73`	`71`	`#ifdef __MPI`