small bug fixed

mohanchen · mohanchen · commit d04e97d05177 · 2025-10-18T12:04:46.000+08:00
diff --git a/source/source_estate/module_charge/chgmixing.cpp b/source/source_estate/module_charge/chgmixing.cpp
@@ -116,10 +116,10 @@ void module_charge::chgmixing_ks(const int iter, // scf iteration number
     // mohan move the following code here, 2025-10-18
     // SCF restart information
     if (PARAM.inp.mixing_restart > 0
-        && iter == this->p_chgmix->mixing_restart_step - 1
+        && iter == p_chgmix->mixing_restart_step - 1
         && iter != PARAM.inp.scf_nmax)
     {
-        this->p_chgmix->mixing_restart_last = iter;
+        p_chgmix->mixing_restart_last = iter;
         std::cout << " SCF restart after this step!" << std::endl;
     }
 

Original file line number	Diff line number	Diff line change
`@@ -116,10 +116,10 @@ void module_charge::chgmixing_ks(const int iter, // scf iteration number`
`116`	`116`	`// mohan move the following code here, 2025-10-18`
`117`	`117`	`// SCF restart information`
`118`	`118`	`if (PARAM.inp.mixing_restart > 0`
`119`		`- && iter == this->p_chgmix->mixing_restart_step - 1`
	`119`	`+ && iter == p_chgmix->mixing_restart_step - 1`
`120`	`120`	`&& iter != PARAM.inp.scf_nmax)`
`121`	`121`	`{`
`122`		`- this->p_chgmix->mixing_restart_last = iter;`
	`122`	`+ p_chgmix->mixing_restart_last = iter;`
`123`	`123`	`std::cout << " SCF restart after this step!" << std::endl;`
`124`	`124`	`}`
`125`	`125`