Remove unused/untested option extrapolateH (#250)

LLNL · Jun 4, 2024 · 7aac379 · 7aac379
1 parent bad80d1
commit 7aac379
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diff --git a/src/OrbitalsExtrapolation.h b/src/OrbitalsExtrapolation.h
@@ -26,8 +26,6 @@ class OrbitalsExtrapolation
 
     virtual ~OrbitalsExtrapolation();
 
-    virtual bool extrapolatedH() const { return false; }
-
     virtual void clearOldOrbitals();
     bool getRestartData(OrbitalsType& orbitals);
     virtual void setupPreviousOrbitals(OrbitalsType** orbitals,

diff --git a/src/md.cc b/src/md.cc
@@ -91,11 +91,6 @@ void MGmol<OrbitalsType>::postWFextrapolation(OrbitalsType* orbitals)
         else
             proj_matrices_->setDMto2InvS();
     }
-    else
-    {
-        if (orbitals_extrapol_->extrapolatedH())
-            dm_strategy_->update(*orbitals);
-    }
 }
 
 template <class OrbitalsType>