fix bug in compile

Author: A-006

source/module_basis/module_ao/test/ORB_unittest.cpp

@@ -28,7 +28,6 @@ void test_orb::TearDown()
 }
     ooo.clear_after_ions(OGT, ORB, 0, nproj);
     delete[] nproj;
-    delete[] orbital_fn;
     return;
 }
 
@@ -75,7 +74,7 @@ void test_orb::set_orbs()
     ORB.init(ofs_running,
                        ntype_read,
                        "./",
-                       orbital_fn,
+                       orbital_fn.data(),
                        descriptor_file,
                        lmax,
                        lcao_ecut,
@@ -114,7 +113,7 @@ void test_orb::set_files()
 
     ModuleBase::GlobalFunc::SCAN_BEGIN(ifs, "NUMERICAL_ORBITAL");
 
-    orbital_fn = new std::string[ntype_read];
+    orbital_fn.resize(ntype_read);
 
     for (int it = 0; it < ntype_read; it++)
     {

source/module_basis/module_ao/test/ORB_unittest.h

@@ -66,7 +66,7 @@ class test_orb : public testing::Test
     int lmax = 1;
     double lat0 = 1.0;
     std::string case_dir = "./GaAs/";
-    std::string* orbital_fn;
+    std::vector<std::string> orbital_fn;
     std::string descriptor_file;
 };
 #endif

source/module_hamilt_lcao/module_deltaspin/test/prepare_unitcell.h

@@ -82,7 +82,7 @@ class UcellTestPrepare
         ucell.atom_mass = new double[ucell.ntype];
         ucell.pseudo_fn = new std::string[ucell.ntype];
         ucell.pseudo_type = new std::string[ucell.ntype];
-        ucell.orbital_fn = new std::string[ucell.ntype];
+        ucell.orbital_fn.resize(ucell.ntype);
         ucell.magnet.start_magnetization = new double[ucell.ntype]; // mag set here
         ucell.magnet.ux_[0] = 0.0;                                  // ux_ set here
         ucell.magnet.ux_[1] = 0.0;

source/module_io/json_output/test/para_json_test.cpp

@@ -338,7 +338,7 @@ TEST(AbacusJsonTest, Init_stru_test)
     double lat0 = 10.0;
     ucell.ntype = 1;
     ucell.pseudo_fn = new std::string[1];
-    ucell.orbital_fn = new std::string[1];
+    ucell.orbital_fn.resize(1);
     ucell.atoms = atomlist;
     ucell.atom_label = new std::string[1];
     ucell.lat0 = lat0;

source/module_io/test/to_qo_test.cpp

@@ -649,8 +649,8 @@ TEST_F(toQOTest, CalculateSelfOvlpRMinimal)
              PARAM.input.qo_screening_coeff);
     std::vector<ModuleBase::Vector3<double>> kvecs_d;
     kvecs_d.push_back(ModuleBase::Vector3<double>(0.0, 0.0, 0.0)); // Gamma point
-    ucell.orbital_fn.data()[0] = "Si_special_use_unittest.orb"; // generated in unittest BuildAo
-    ucell.orbital_fn.data()[1] = "C_special_use_unittest.orb"; // generated in unittest BuildAo
+    ucell.orbital_fn[0] = "Si_special_use_unittest.orb"; // generated in unittest BuildAo
+    ucell.orbital_fn[1] = "C_special_use_unittest.orb"; // generated in unittest BuildAo
     ucell.atoms[1].nwl = 1; // only s and p for C
     tqo.initialize(PARAM.sys.global_out_dir,
                    "",
@@ -718,8 +718,8 @@ TEST_F(toQOTest, CalculateSelfOvlpKSymmetrical)
              {"minimal-nodeless", "minimal-nodeless"},
              PARAM.input.qo_thr,
              PARAM.input.qo_screening_coeff);
-    ucell.orbital_fn.data()[0] = "Si_special_use_unittest.orb"; // generated in unittest BuildAo
-    ucell.orbital_fn.data()[1] = "C_special_use_unittest.orb"; // generated in unittest BuildAo
+    ucell.orbital_fn[0] = "Si_special_use_unittest.orb"; // generated in unittest BuildAo
+    ucell.orbital_fn[1] = "C_special_use_unittest.orb"; // generated in unittest BuildAo
     ucell.atoms[1].nwl = 1; // only s and p for C
 
     std::vector<ModuleBase::Vector3<double>> kvecs_d;
@@ -894,8 +894,8 @@ TEST_F(toQOTest, CalculateSelfOvlpRFull)
              PARAM.input.qo_screening_coeff);
     std::vector<ModuleBase::Vector3<double>> kvecs_d;
     kvecs_d.push_back(ModuleBase::Vector3<double>(0.0, 0.0, 0.0)); // Gamma point
-    ucell.orbital_fn.data()[0] = "Si_special_use_unittest.orb"; // generated in unittest BuildAo
-    ucell.orbital_fn.data()[1] = "C_special_use_unittest.orb"; // generated in unittest BuildAo
+    ucell.orbital_fn[0] = "Si_special_use_unittest.orb"; // generated in unittest BuildAo
+    ucell.orbital_fn[1] = "C_special_use_unittest.orb"; // generated in unittest BuildAo
     ucell.atoms[1].nwl = 1; // only s and p for C
     PARAM.input.qo_thr = 1e-10;
     tqo.initialize(PARAM.sys.global_out_dir,