[pre-commit.ci lite] apply automatic fixes

Author: pre-commit-ci-lite[bot]

source/module_hamilt_general/operator.cpp

@@ -11,7 +11,8 @@ Operator<T, Device>::Operator(){}
 template<typename T, typename Device>
 Operator<T, Device>::~Operator() 
 {
-    if(this->hpsi != nullptr) delete this->hpsi;
+    if(this->hpsi != nullptr) { delete this->hpsi;
+}
     Operator* last = this->next_op;
     Operator* last_sub = this->next_sub_op;
     while(last != nullptr || last_sub != nullptr)
@@ -100,9 +101,11 @@ void Operator<T, Device>::init(const int ik_in)
 template<typename T, typename Device>
 void Operator<T, Device>::add(Operator* next) 
 {
-    if(next==nullptr) return;
+    if(next==nullptr) { return;
+}
     next->is_first_node = false;
-    if(next->next_op != nullptr) this->add(next->next_op);
+    if(next->next_op != nullptr) { this->add(next->next_op);
+}
     Operator* last = this;
     //loop to end of the chain
     while(last->next_op != nullptr)

source/module_hsolver/diago_iter_assist.cpp

@@ -212,7 +212,7 @@ void DiagoIterAssist<T, Device>::diagH_subspace_init(hamilt::Hamilt<T, Device>*
         {
             // psi_temp is one band psi, psi is all bands psi, the range always is 1 for the only band in psi_temp
             syncmem_complex_op()(ctx, ctx, ppsi, psi + i * psi_nc, psi_nc);
-            psi::Range band_by_band_range(1, 0, 0, 0);
+            psi::Range band_by_band_range(true, 0, 0, 0);
             hpsi_info hpsi_in(&psi_temp, band_by_band_range, hpsi);
 
             // H|Psi> to get hpsi for target band
@@ -256,7 +256,7 @@ void DiagoIterAssist<T, Device>::diagH_subspace_init(hamilt::Hamilt<T, Device>*
 
         T* hpsi = temp;
         // do hPsi for all bands
-        psi::Range all_bands_range(1, 0, 0, nstart - 1);
+        psi::Range all_bands_range(true, 0, 0, nstart - 1);
         hpsi_info hpsi_in(&psi_temp, all_bands_range, hpsi);
         pHamilt->ops->hPsi(hpsi_in);
 
@@ -586,8 +586,9 @@ bool DiagoIterAssist<T, Device>::test_exit_cond(const int& ntry, const int& notc
     //================================================================
 
     bool scf = true;
-    if (PARAM.inp.calculation == "nscf")
+    if (PARAM.inp.calculation == "nscf") {
         scf = false;
+}
 
     // If ntry <=5, try to do it better, if ntry > 5, exit.
     const bool f1 = (ntry <= 5);