Commit 1ca11bee authored by Francois Gygi's avatar Francois Gygi
Browse files

reset velocities at end of CG ionic step

git-svn-id: cba15fb0-1239-40c8-b417-11db7ca47a34
parent 349283e1
......@@ -94,4 +94,5 @@ void CGIonicStepper::compute_r(double e0, const vector<vector<double> >& f0)
r0_ = rp_;
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