<div dir="ltr"><div><div><div>Dear Wien2k community,<br><br></div> I would like some general hints for a system with a difficult charge convergence. <br> In my case, I got the energy convergence (-ec 0.0001), but not the charge one (-cc 0.0001). <br>
Would it be acceptable to increase the charge convergence criterion to -cc 0.0005 ? I am getting charge changes bellow this value.<br></div> All the best,<br></div> Luis<br></div>