<div dir="ltr">Hi Teodore<br><br>You can try to use Cartesian coordinate (i.e., xyz), what you have to do is to transform the cif file to xyz using VESTA or Avogadro. Hope it help<br><br>Best<br>Saleh  </div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Aug 4, 2023 at 10:49 AM Teodora Kirova <<a href="mailto:tvkirova@gmail.com">tvkirova@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex">Hi all, I am new to cp2k and have some questions. <div>I am trying to use TOPOLOGY with a .cif file, which I got from the materials project.</div><div>However the running process is aborted  ( see attachment). How can I fix that?</div><div>Thanks!</div>

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