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Dear Ankit
<div class="">Taking a quick look at your final WFs, they are not localised (some spreads > 100 A^2) and they are not real (max Im/Re ratio > 1). So you have not achieved a successful Wannierisation and I suspect this is the source of the problem as the quantum
transport part relies on having well-localised WFs.</div>
<div class="">Best wishes,</div>
<div class="">Arash</div>
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<div>— <br class="">
Professor Arash Mostofi — <a href="http://www.mostofigroup.org" class="">www.mostofigroup.org</a><br class="">
Director, Thomas Young Centre @Imperial<br class="">
Imperial College London</div>
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<div class="">On 27 Jan 2021, at 16:10, Ankit Sirohi <<a href="mailto:ankitvlsi16@gmail.com" class="">ankitvlsi16@gmail.com</a>> wrote:</div>
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<div class="">Dear experts,</div>
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<div class="">I was wondering if there is a solution to this issue. <br class="">
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<div class="">I emailed you a few days back and I am checking in to see if you have an answer to this query.</div>
<div class="">I appreciate your help.</div>
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<div class="">Thank you for your time in advance.</div>
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<div class="">Ankit Sirohi<br class="">
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<div dir="ltr" class="gmail_attr">On Sun, Jan 24, 2021 at 9:08 PM Ankit Sirohi <<a href="mailto:ankitvlsi16@gmail.com" class="">ankitvlsi16@gmail.com</a>> wrote:<br class="">
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<div class="">Dear Users,</div>
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<div class="">I am calculating DOS and quantum conductance using wannier90 in graphene armchair nanoribbons. But the bandgap in DOS, as well as in quantum conductance, is not matching with the bandgap in interpolated bandstructure.
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<div class="">I am attaching the input, output files as well as the plotted results.<br class="">
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<div class="">I kindly request the experts to help me in this regard.</div>
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<div class="">Thank You,</div>
<div class="">Ankit Sirohi.</div>
<div class="">Research Scholar.</div>
<div class="">Department of Electrical Engineering<br class="">
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<div class="">Indian Institute of Technology.</div>
<div class="">Patna</div>
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